Talk:20.109(S17):Module 1

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20.109(S17): Laboratory Fundamentals of Biological Engineering

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Schedule Spring 2017        Announcements        Assignments        Homework        Communication
       1. High-throughput ligand screening        2. Gene expression engineering        3. Biomaterials engineering              

GAL and TIF files for SMM screen data analysis

Here are the class's .gal files.

You can find your scan images and set number(s) in this table:

team slide1 slide2
T/R
red 14399983, set 1 14400077, set 4
yellow 14400113, set 2 14400139, set 3
green 14400114, set 2 14400140, set 3
blue 14399984, set 5 14399988, set 6
pink 14400072, set 5 14399987, set 6
purple 14399983, set 1 14400128, set 7
white 14400077, set 4 14399959, set 8
W/F
red 14400129, set 7 14400081, set 9
yellow 14400128, set 7 14399959, set 8
green 14400143, set 11 14399950, set 12
blue 14400147, set 10 14399951, set 12
pink 14400146, set 10 14399947, set 11
purple 14399980, set 8 14400082, set 9


Top hits analyzed by Rob Wilson

Your dedicated and brilliant TA Rob Wilson manually confirmed the top-ranking ~1000 compounds of the class's SMM screen. 72 can be recognized as hits with high confidence, and in total, 134 would be worth a hypothetical secondary screen. This corresponds to hit rate of about 0.15%, low and reasonable in the Koehler Lab's viewpoint. The conserved structures Rob discussed in class are: a 7-azaindole and a 3,4 cis pyrrolidine with a nearby tertiary amine non-aromatic heterocycle.

The top 2000 hits have been curated and compiled in this spreadsheet.

You'll find in this table more details about your individual slides results, with not only robust z scores but also fluorescence spots and chemical structures:

team slide1 slide2
T/R
red 14399983 14400077
yellow 14400113 14400139
green 14400114 14400140
blue 14399984 14399988
pink 14400072 14399987
purple 14399983 14400128
white 14400077 14399959
W/F
red 14400129 14400081
yellow 14400128 14399959
green 14400143 14399950
blue 14400147 14399951
pink 14400146 14399947
purple 14399980 14400082

CSV and pivot tables for Rob

T/R

Red
Media:14400077-4.csv Media:14399983-1.csv

Yellow
14400113 spot intensities.csv 14400139 spot intensities.csv

Green
14400114 A1-2.csv 14400140-A1-3.csv

Blue
14399984 5SpotIntensity workbook.xlsx 14399988-6 workbook.xlsx

Pink
Media:14400072_new.xlsx Media:14399987_new.xlsx

White
Media:14400077 spot intensities.csv Media:14399959 spot intensities.csv

SMILES of hits

Copy/paste below the SMILES describing your hits, from the A column of your Excel pilot table.
They look like CNCCN1[C@@H]2CCN(C[C@@H]2CCC1=O)CC3=CC=CS3, for instance.

T/R

Red

14399988:

O[C@@H]1CC[C@H](C[C@H]1OC)C[C@@H](C)[C@@H]4CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(/C)[C@@H](OC)C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O4

C1CN(CCC12[C@@H](C[C@@H]2OCCO)O)CC3=C(C=C(C=C3)C(F)(F)F)F

CN(C)C1=NC(=NC2=C1CCN(C2)C(=O)[C@H]3CCCN3)C4=CC=CC=C4

C1COC2=C(CN1CC3=CC=C(C=C3)O)C=C(C=C2O)C4=CC(=CC=C4)Cl

CC(=O)N[C@@H]1CN(C[C@H]1C2=CC=C(C=C2)OC)C(=O)CCC3=CN=CC=C3


1400077:

O[C@@H]1CC[C@H](C[C@H]1OC)C[C@@H](C)[C@@H]4CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(/C)[C@@H](OC)C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O4

CC1=NC2=CC=CC=C2N(C1=O)CC(=O)N3CC[C@@H]4[C@H]3CNC4

CNC1=NC2=C(C=CN2)C(=C1)C3=NC=C(C=C3)CN

CN(C)CC1(CCN(C1)CC2=CC(=C(C=C2)O)C(=O)O)O

CCNC(=O)[C@@H]1C[C@H](CN1C(=O)CSC2=NC=NC3=C2C=C(S3)C)N


Yellow

14400139:

CCN(CCO)C[C@@H]1CN(C[C@@H]1CO)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N)C

CCC1=C(C2=CC(=CC(=C2N1)CNC(=O)C3=CC(=NC=C3)N)F)C

COC\1=CC(=O)C=C/C1=C/2\C3=C(C4=C(C3)C(=CC=C4)O)NC(=C2C#N)N

CCCOC1=C(C=C(C=C1)C(=O)N[C@H]2COC[C@H]2CC3=CC(=NO3)C)Cl

CC1=NN(C(=N1)[C@H](CC2=CC=C(C=C2)O)N)C3=CC=CC4=C3N=CC=C4


14400113:

C1CN(CCC12CC(=O)N(C2)CC3=CC=C(C=C3)Cl)C(=O)[C@@H]4C[C@H](CN4)O

CCOC(=O)C1=COC(=N1)N2CC[C@H]([C@@H](C2)O)N(C)CCC3=CC=CC=N3

CN(C)C[C@@H]1CN(C[C@@H]1CO)C(=O)C2=CC(=CC(=C2)OC)OC

CCC[C@@H]1CN(C[C@H]1NS(=O)(=O)C)C2=NN=NN2C3=CC=CC=C3

COC1=C(C=CC(=C1)CNCCN2CCNC2=O)OCC(CN3CCCCCCC3)O


Green Top 10 hits across slides 14400114 and 14400140

CCN1C(=CC=N1)S(=O)(=O)N2C[C@@H]3C4=CC=CC=C4OC[C@@]3(C2)C(=O)O

O[C@@H]1CC[C@H](C[C@H]1OC)C[C@@H](C)[C@@H]4CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(/C)[C@@H](OC)C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O4

CCN(CC1=CC=C(C=C1)C(=O)NC2=C(C=CS2)C#N)[C@H]3COC[C@@H]3O

CC1=C(C(=CC=C1)Cl)S(=O)(=O)NC2=C(N(N=C2C)CC(=O)O)C

CC(=O)NCCNCC1=C(C=C(C=C1)OC)OCC(CN2CCCC2)O

CN1C2=C(C=C(C=C2)C(=O)NCC(F)(F)F)N=C1N3CC[C@@H](C3)O

COC1=C(C=CC(=C1)CNCCN2CCNC2=O)OCC(CN3CCCCCCC3)O

O[C@@H]1CC[C@H](C[C@H]1OC)C[C@@H](C)[C@@H]4CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(/C)[C@@H](OC)C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O4

CCCC1=NC(=CC(=N1)N2C[C@H]([C@H](C2)CO)CN3CCCCCC3)C

CN1CCN(CC1)C[C@@H]2CN(C[C@@H]2CO)CC3=CC(=CS3)CN(C)C

Visualization of top 5: Green Team Top 5 Smiles .cds

Blue

14399984:

O[C@@H]1CC[C@H](C[C@H]1OC)C[C@@H](C)[C@@H]4CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(/C)[C@@H](OC)C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O4

C1C[C@@H]([C@@H]1N)NC(=O)C2=CC3=CC=CC=C3OC=C2

CC1=C(C=CC(=C1)Cl)NC(=O)N2C[C@@H]3CC[C@H](C2)N(C3)C

C1CCCN(CC1)C[C@@H]2CN(C[C@@H]2CO)C(=O)C3=CC(=O)NC(=O)N3

C1=CC(=CN=C1)CNC2=NC3=C(C=CN3)C(=C2)C4=NC=C(C=C4)N

14399988:

C1C(C2=C(NC1=O)N=C(C=C2)N)C3=CN(N=C3)C4=CC=C(C=C4)Cl

CNCCN1[C@@H]2CCN(C[C@@H]2CCC1=O)C(=O)/C=C/C3=CC=CC=C3

O[C@@H]1CC[C@H](C[C@H]1OC)C[C@@H](C)[C@@H]4CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(/C)[C@@H](OC)C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O4

C[C@H]([C@@H](C(=O)N1CCC2=C(C1)C=C(C=C2)S(=O)(=O)NC3CCC3)N)O

CCN1C=CN=C1C2CCN(CC2)C(=O)CNC(=O)N

Pink

14400072:

C1C(CC2=CC=CC=C21)N3C(=NC(=N3)C4=CC=C(C=C4)C(=O)N)CNC(=O)N

CC1=C(C=C(C=C1)C(=O)NC2CCC(CC2)N3C=NN=C3)N4CCNC4=O

C1CCCN(CC1)C[C@@H]2CN(C[C@@H]2CO)CC3=CN=CC=C3

C1=CC(=CN=C1)CNC2=NC3=C(C=CN3)C(=C2)C4=NC=C(C=C4)N

C1=C/C(=C\2/C=C(NC3=C2C=CN3)NCCO)/C=C4C1=CC(=O)C=C4

C1CCN(CC1)C[C@@H]2CN(C[C@@H]2CO)CC3=CN=CC=C3

CC1=NC(=O)C=C(N1)C2CCN(CC2)C(=O)[C@@H]3C[C@H]4C[C@@H]3C=C4

C1CN(CC2=C1C(=O)N=C(N2)C3=CC=CC=N3)C(=O)[C@@H]4CC(CN4)(F)F

CN(C)C[C@@H]1CN(C[C@@H]1CO)C(=O)C2=CC(=C(C=C2)N3CCCC3)Cl

C1CCN(CC1)[C@H]2COC[C@@H]2NC3=NC4=C(C=C3)C=CN4

CN1CCN([C@@H]2[C@H]1CS(=O)(=O)C2)C(=O)CC3=CC=CC=C3O

CC1=CN=C(N=C1NC[C@@H]2CCCN3[C@@H]2CCCC3)N

CC(C(=O)O)OC1=C(C=C(C=C1)C2=CC(=NC3=C2C=CN3)N)Cl

CC1=CN=C(N=C1NCC[C@@H]2C[C@H]3C[C@@H]2C=C3)N

C1CCN(CC1)C[C@@H]2CN(C[C@@H]2CO)C(=O)CCCN3C=CN=C3

C1CN(C[C@H]1O)C2=NC3=C(C=CN3)C(=C2)Cl

C1=CC(=CC=C1C2=CC(=NC3=C2C=CN3)N)C4=CSC(=N4)N

C1CCCN(CC1)C[C@@H]2CN(C[C@@H]2CO)C(=O)C3=CC=C(O3)CN4C=CN=C4


14399987:

C1C(C2=C(NC1=O)N=C(C=C2)N)C3=CN(N=C3)C4=CC=C(C=C4)Cl

CN1C[C@H](C[C@H]1C(=O)OC)NC(=O)C2=CNC(=O)C=N2

CC1=CC2=CC=CC=C2N1CCC(=O)N3CCC4(CC3)[C@@H](C[C@@H]4OCCO)O

C1CN(C2=CC=CC=C21)CCCNCC3(CCNC3)O

C1C[C@H]2C[C@@H]1[C@@H]3[C@H]2CN(C3)C(=O)NC4=CC(=CC(=C4F)F)F

CCCC1=CC(=NC(=N1)C)N2CCC(CC2)N[C@H]3CC4=CC=CC=C4[C@@H]3N

COC1=CC(=CC=C1)OCC2=CC(=NN2)C(=O)N3[C@@H]4CC[C@H]3CC(C4)O

CCC1=NC(=C(N1)C)[C@H]2CN(C[C@@H]2C(=O)NCC34CCCN3CCC4)C

COCCNC1=NC2=C(C=CN2)C(=C1)C3=CC=C(C=C3)C4(CCNCC4)O

COC1=NC(=NC(=C1)C2=CC(=NC3=C2C=CN3)NC4CCCC4)N

C1CNCCC1NC2=NC3=C(C=CN3)C(=C2)C4=CC(=CN=C4)C(=O)N

C1CCC(C1)NC2=NC3=C(C=CN3)C(=C2)C4=CC(=CC=C4)CCN

COCCNC1=NC2=C(C=CN2)C(=C1)C3=CC=C(C=C3)C4=CN=C(N4)N

C1[C@H]([C@@H](CN1C(=O)C2=CN=C3N(C2=O)C=CS3)C(=O)O)C4=CC=CC=C4

CC1=C(C=C(C=C1)C(=O)N2CC[C@@H]([C@@H](C2)CCC(=O)O)N3CCN(CC3)C)O

CN1CCN2C[C@H](C[C@H]2C1)NC(=O)C3=CC=CC(=C3)C4=CNN=C4

Purple 14400128-7

C1CCN(CC1)C[C@@H]2CN(C[C@@H]2CO)CC3=C(N=CC=C3)N

C1CCN(C1)C2=CC=CC(=C2)CNC(=O)C3=CN(N=N3)C4CCC(CC4)N

C1CNCCC1(C2=CC=C(C=C2)C3=CC(=NC4=C3C=CN4)N)O

CC1=C[C@@H](N([C@H](C1)CC=C)C(=O)C(=O)NC2=NOC(=C2)C)CC=C

C[C@@H]1C=CC[C@H](N1C(=O)C2=CC3=C(CCCC3)NC2=O)CC=C

C[C@@H](CO)NC(=O)C1=C(C=CC(=C1)OC)OC2CCN(CC2)C3CCCC3

C1CC(CNC1)CN2C=C(N=N2)C(=O)N3CCN(CC3)S(=O)(=O)N

C1CCC2=NN=C(N2CC1)CNC(=O)[C@@]34CNC[C@@H]3CN(C4)C5CCCC5

CC(=CCC/C(=C/CN1CC[C@H]([C@@H](C1)O)NC(=O)C2=CC=NC=C2)/C)C

CN1CCCN(CC1)C[C@@H]2CN(C[C@@H]2CO)CC3=CC=C(C=C3)SC

14399983-1

COCCNC1=NC2=C(C=CN2)C(=C1)C3=NC=CC(=N3)N

C1CC2=CC=CC=C2C(C3=CC=CC=C31)CC(=O)NCC4=NN=C(S4)N

CC(C)[C@@H]1CN(C[C@H]1NS(=O)(=O)N(C)C)C(=O)C2=C(C=CS2)N

CC(C1CCN(CC1)C(=O)C2=C(C(=CC=C2)O)O)N3CCOCC3

CC1=C(C(=NN1CCO)C)NC(=O)CCC2=NN3CCNCC3=C2

C1CC(CCC1C2CC(=O)N=C3C2=CC4=CNNC4=C3)N

CC1=CC(=C(C=C1)NC(=O)CC(=O)N[C@@H](CC2=CC=CC=C2)CO)C

COC1=CC=CC(=C1)C2=C(C=NN2)C(=O)NCCNS(=O)(=O)C

C1=CNC2=C1C(=CC(=N2)N)C3=CSC(=C3)C(=O)O

CC1=C(C=CC=C1O)C(=O)N2CCN([C@H]3[C@@H]2CS(=O)(=O)C3)C(=O)CC(C)C

C/C(=C\C1=C(C=CC(=C1)Cl)O)/CN2C[C@@H](C[C@H]2C(=O)OC)N(C)C

CCN(CC)C(=O)[C@@H]1C[C@H](CN1CC2=CN=CN2)NC(=O)C3=C(NC=C3)C

CN(C)CC1=C/C(=C\2/C3=C(C4=C(CC3)NC=C4)NC(=C2C#N)N)/C=CC1=O

COC[C@@H]1CCCN1C(=O)NC2=C(C=C(C=C2)Cl)C(F)(F)F

White

14400077:

CNC1=NC2=C(C=CN2)C(=C1)C3=NC=C(C=C3)CN

CC1=NC2=CC=CC=C2N(C1=O)CC(=O)N3CC[C@@H]4[C@H]3CNC4

CN(C)CC1(CCN(C1)CC2=CC(=C(C=C2)O)C(=O)O)O

CC(C)CC1=NN(C(=C1)C(=O)N[C@@H](CC(C)C)CO)C

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC(=NC4=C3C=CN4)NCCO)C(=O)O

C1CCC(C1)NC2=NC3=C(C=CN3)C(=C2)C4=CC=C(C=C4)C5=CN=C(N5)N

COC1=C(C=C(C=C1)C2=CC(=NC3=C2C=CN3)NCCO)C(F)(F)F

CC1=CC=C(C=C1)NC(C)(C2=CC=CC=C2)C(=O)NCCC3=NN=C(S3)N

C1CN(CCC1OC2=CC=CC(=C2)C(F)(F)F)C(=O)C3[C@H]4[C@@H]3CNC4

CN1C[C@@H]2CC[C@@H](N2C(=O)NC3=CC=CC=C3C4=CC(=CC=C4)OC)CC1=O

C1CCN2C(=NN=C2CNC(=O)C3=CN(N=N3)C4CCC(CC4)N)C1

CN(C)CC1=CSC(=C1)CN2C[C@H]([C@H](C2)CO)CN3CCCCCC3

C1CCCN(CC1)C[C@@H]2CN(C[C@@H]2CO)CC3=CC4=C(C=C3)NC=C4

CCNC(=O)C1=CC=CC(=C1)C2=CC(=NC3=C2C=CN3)NCCO

CCN1C=CC2=C(C=CC=C21)CN3[C@@H]4CC[C@H]3CNC(=O)C4

14399959:

CC1=C(N=C(N=C1N2C[C@H]([C@H](C2)CO)CN3CCCCC3)N4CCCC4)C

CC1=C(N=C(N=C1N2C[C@H]([C@H](C2)CO)CN3CCCCCC3)N(C)C)C

CCN(CC)C(=O)[C@@H]1C[C@@H](CN1C)NC(=O)C2=CC3=C(C=C2)OC(=C3)C

C1CC2=CC=CC=C2N(C1)CCNCC3(CCNC3)O

C1CCN(C1)C[C@@H]2CN(C[C@@H]2CO)CC3=CC=CC=N3

CC1=NN(C=C1[C@@H]2C[C@@H](C[C@@H](O2)CCC3=CC=CC=C3)NC(=O)C)CC=C

C1C=CC[C@@H]2[C@H]1CN(C2)C(=O)C3=CC=C(O3)CO

CC1=C(N=CN=C1N2C[C@H]([C@H](C2)CO)CN3CCCC3)C

CCCC1=CN=C(N=C1N2C[C@H]([C@H](C2)CO)CN3CCC(CC3)O)C

CCC1=NN=C(S1)NC(=O)C(=O)N2[C@@H](C=CC[C@H]2CC=C)C

CCC1=C(N=C(N=C1N2C[C@H]([C@H](C2)CO)CN(C)C)C)C

C1CCN(CC1)C[C@@H]2CN(C[C@@H]2CO)CC3=CC=CC(=C3)C#N

C[C@@H]1CN(C[C@@H](O1)C)CCC(=O)NCCC2CN(CCO2)C

CC(C)OC1=NC(=NC(=C1)C2=CC(=NC3=C2C=CN3)NCCO)N

CC1=CC=C(O1)CN2C[C@H]([C@H](C2)CO)CN3CCOCC3

CN(C)C[C@@H]1CN(C[C@@H]1CO)CC2=C(N=CC=C2)N

CN(C)[C@@H]1C[C@H](N(C1)C(=O)CSCCN2CCCC2)CO

CN1CCN(CC1)C[C@@H]2CN(C[C@@H]2CO)CC3=CC=CC(=C3)C4=CC=CO4

W/F

Red 14400129:

C=CC1=CC=C(C=C1)C(=O)N2CC[C@H]3CC[C@@H](C2)N3

C1CN(C[C@H]([C@@H]1N2CCN(CC2)C3=CC=CC=C3F)O)C4=CC(=NC=N4)N

C1CCN(CC1)CC2(CCN(C2)CC3=CC=CC(=C3)CCN)O

CCNC(=O)[C@@H]1C[C@H](CN1C(=O)C2=CC=C(C=C2)C=C)N

O[C@@H]1CC[C@H](C[C@H]1OC)C[C@@H](C)[C@@H]4CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(/C)[C@@H](OC)C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O4

C1CNCCC1(C2=CC=C(C=C2)C3=CC(=NC4=C3C=CN4)N)O

14400081:

COC1=NC(=NC(=C1)C2=CC(=NC3=C2C=CN3)NCC4=CC=NC=C4)N

CC1=C(SC=C1)[C@@H]2CCN(C[C@H]2O)C(=O)C3=CC(=NC(=N3)N)C(C)C

O[C@@H]1CC[C@H](C[C@H]1OC)C[C@@H](C)[C@@H]4CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(/C)[C@@H](OC)C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O4

CN1C[C@@H]2CC[C@@H](N2C(=O)NC3=CC=CC(=C3)C#N)CC1=O

CC1=CC(=CC=C1)CC2(CC2)NC(=O)[C@@H]3C[C@H](CNC3)C(=O)N4CCCC4

Yellow 14400128:

C=CC1=CC=C(C=C1)C(=O)N2CC[C@H]3CC[C@@H](C2)N3

CCNC(=O)[C@@H]1C[C@H](CN1C(=O)C2=CC=C(C=C2)C=C)N

C1CCN(CC1)CC2(CCN(C2)CC3=CC=CC(=C3)CCN)O

C1CCN(CC1)C[C@@H]2CN(C[C@@H]2CO)CC3=C(N=CC=C3)N

C1CCN(C1)C2=CC=CC(=C2)CNC(=O)C3=CN(N=N3)C4CCC(CC4)N

14399959:

CC1=C(N=C(N=C1N2C[C@H]([C@H](C2)CO)CN3CCCCC3)N4CCCC4)C

CC1=C(N=C(N=C1N2C[C@H]([C@H](C2)CO)CN3CCCCCC3)N(C)C)C

CCN(CC)C(=O)[C@@H]1C[C@@H](CN1C)NC(=O)C2=CC3=C(C=C2)OC(=C3)C

C1CC2=CC=CC=C2N(C1)CCNCC3(CCNC3)O

C1CCN(C1)C[C@@H]2CN(C[C@@H]2CO)CC3=CC=CC=N3

Green

14399950:

C1CCN(CC1)CC(COC2=CC=C(C=C2)CN3CC(C3)O)O

O[C@@H]1CC[C@H](C[C@H]1OC)C[C@@H](C)[C@@H]4CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(/C)[C@@H](OC)C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O4

COC1=C(C=CC(=C1)CN2CCC2)OCC(CN3CCCC3)O

CO[C@H]1[C@@H](C2=CC=CC=C2C13CCN(CC3)CC4=CC5=C(C=C4)OCO5)NC(=O)CC6=CC=CC=C6

CC(C)C(=O)N[C@@H]1C[C@H](N(C1)CC2=CC=CC=C2C(F)(F)F)C(=O)OC

14400143:

CC1=NC=C2CNCCC2=C1CNC(=O)C3=C(C=CC4=CC=CC=C43)O

O[C@@H]1CC[C@H](C[C@H]1OC)C[C@@H](C)[C@@H]4CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(/C)[C@@H](OC)C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O4

C1CC(CCC1NC(=O)C2=CC=CC3=NN=NN32)N4C=NN=C4

COCCN1CCCC(C1=O)(CN2CCC3(CC2)C(=O)NC4=CC=CC=C4N3)O

C1CC(CN(C1)C2=NC(=NC3=C2CCNCC3)N)CN4CCCC4=O


Blue

Slide 14400147:

O[C@@H]1CC[C@H](C[C@H]1OC)C[C@@H](C)[C@@H]4CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(/C)[C@@H](OC)C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O4

C1=CC(=NC=C1C2=CC(=NC3=C2C=CN3)NCCO)N

CCC1=CN=C(N=C1N2C[C@H]([C@H](C2)CO)CN3CCCCC3)C

CN1C=CN=C1CN2C[C@H]([C@H](C2)CO)CN3CCCCCC3

C1CC(CCC1N)N2C=C(N=N2)C(=O)NCCCNC3=CN=CC=C3

Slide 14399951:

C1CNCC(C12CCN(CC2)C3=CC=CC(=N3)C(=O)N)CO

C1CCN(CC1)CC(COC2=CC=C(C=C2)CN3CC(C3)O)O

O[C@@H]1CC[C@H](C[C@H]1OC)C[C@@H](C)[C@@H]4CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(/C)[C@@H](OC)C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O4

C1=CC(=CC(=C1)CCN)C2=CC(=NC3=C2C=CN3)NCCO

C1CCC(=O)N(CC1)CC(=O)N2CCN(CC(C2)O)CC3=CC=CC=C3


Pink Slide 14399947 CC1=CC2=C(C=C1)N(C(=C2)C(=O)NCC(COC3=CC=C(C=C3)OC)O)C

C[C@@H]1C[C@H](NC(=S)N1)C(=O)NCC2CC3=CC=CC(=C3O2)C4=CC=CC=C4C(F)(F)F

CN1C(=CC=N1)CCNC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3CCOC3

C1=CNC2=C1C(=CC(=N2)NCC3=CC=NC=C3)C4=CC(=C(N=C4)N)Cl

CCC[C@H]1CN(C[C@@H]1NC2=NC(=CN=C2)C(=O)N(C)C)C(=O)C

Slide 14400146 CC1=NOC(=C1)C[C@@H]2COC[C@@H]2NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)OC

CC1=CC(=NO1)NS(=O)(=O)C2=CC3=C(CCN(C3)C(=O)[C@@H]4CCCO4)C=C2

C1=CC(=NC=C1C2=CC(=NC3=C2C=CN3)NCCO)N

C1CN(CC1N)C2=NC(=NC3=C2CCNC3)C4=CN=CC=C4

CCC1=CN=C(N=C1N2C[C@H]([C@H](C2)CO)CN3CCCCC3)C



Purple

14399980 - rapamycin could not be discerned.

14400082:

C[C@@H]1CN(CCN1)C2=CC(=NC3=CC(=NN32)C)C(C)C \C=C\C=C(/C)[C@@H](OC)C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O4 C1CCC2=C(C1)C=C(C=N2)C(=O)N[C@@H]3CCCNC3 C1CNC[C@H]1NC(=O)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CC=N3 C1=CC=C(C(=C1)CCCNCC2=CN(C3=CC=CC=C32)CCC(=O)N)O

COC1=NC(=NC(=C1)C2=CC(=NC3=C2C=CN3)NCC4=CC=NC=C4)N