TAOK3

Reference Set (107 Compounds)

CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 ZINC000003814434

ZINC000003814434 (search)

CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1 ZINC000023247639

ZINC000023247639 (search)

$Cc1[nH]c(/C=C2\C(=O)Nc3ccc(S(=O)(=O)Cc4c(Cl)cccc4Cl)cc32)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1 ZINC000003938668$

ZINC000003938668 (search)

COc1cc(N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1 ZINC000055760827

ZINC000055760827 (search)

Cc1ccc(Nc2nccc(N(C)c3ccc4c(C)n(C)nc4c3)n2)cc1S(N)(=O)=O ZINC000011617039

ZINC000011617039 (search)

O=C(NC1CCNCC1)c1n[nH]cc1NC(=O)c1c(Cl)cccc1Cl ZINC000016052857

ZINC000016052857 (search)

Cc1cc(Nc2cc(N3CCN(C)CC3)nc(Sc3ccc(NC(=O)C4CC4)cc3)n2)[nH]n1 ZINC000003820040

ZINC000003820040 (search)

C[C@]12O[C@H](C[C@]1(O)CO)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)CNC4=O ZINC000003781738

ZINC000003781738 (search)

CN(C)C[C@@H]1CCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCO1 ZINC000003812168

ZINC000003812168 (search)

CN1CC[C@H](c2c(O)cc(O)c3c(=O)cc(-c4ccccc4Cl)oc23)[C@H](O)C1 ZINC000021288966

ZINC000021288966 (search)

Nc1nccc(-c2cc3c([nH]2)[C@@H](CCF)CNC3=O)n1 ZINC000039144346

ZINC000039144346 (search)

$CCN(CC)CCNC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1C ZINC000003964325$

ZINC000003964325 (search)

COc1ccc(F)c(F)c1C(=O)c1cnc(NC2CCN(S(C)(=O)=O)CC2)nc1N ZINC000013983251

ZINC000013983251 (search)

Cc1ccc(F)c(NC(=O)Nc2ccc(-c3cccc4[nH]nc(N)c34)cc2)c1 ZINC000006718813

ZINC000006718813 (search)

$Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1 ZINC000018825344$

ZINC000018825344 (search)

COc1cc(Nc2c(C#N)cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)c(Cl)cc1Cl ZINC000022448983

ZINC000022448983 (search)

CSc1cccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)c1 ZINC000002047743

ZINC000002047743 (search)

C[C@@H](Oc1cc(-c2cnn(C3CCNCC3)c2)cnc1N)c1c(Cl)ccc(F)c1Cl ZINC000035902489

ZINC000035902489 (search)

CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc21 ZINC000036056301

ZINC000036056301 (search)

N#CC[C@H](C1CCCC1)n1cc(-c2ncnc3[nH]ccc23)cn1 ZINC000043207851

ZINC000043207851 (search)

CC(C)(C)c1cnc(CSc2cnc(NC(=O)C3CCNCC3)s2)o1 ZINC000003816409

ZINC000003816409 (search)

Cn1c(Nc2ccc(C(F)(F)F)cc2)nc2cc(Oc3ccnc(-c4ncc(C(F)(F)F)[nH]4)c3)ccc21 ZINC000018710085

ZINC000018710085 (search)

O=C(c1ccc(/C=C/c2n[nH]c3ccccc23)cc1)N1CCNCC1 ZINC000043201999

ZINC000043201999 (search)

Cc1n[nH]c2ccc(-c3cncc(OC[C@@H](N)Cc4ccccc4)c3)cc12 ZINC000016052569

ZINC000016052569 (search)

C[C@@H](Oc1cc(-n2cnc3ccc(CN4CCN(C)CC4)cc32)sc1C(N)=O)c1ccccc1C(F)(F)F ZINC000043154472

ZINC000043154472 (search)

CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3c(cc2OC)CCN3C(=O)CN(C)C)nc2[nH]ccc12 ZINC000043202844

ZINC000043202844 (search)

Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1 ZINC000006716957

ZINC000006716957 (search)

CC[C@@H]1C(=O)N(C)c2cnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC)nc2N1C1CCCC1 ZINC000013986815

ZINC000013986815 (search)

Cc1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1Nc1cccc(S(=O)(=O)NC(C)(C)C)c1 ZINC000019862646

ZINC000019862646 (search)

CN(C)CC(=O)N1CCC(c2ccc(NC(=O)c3nc(C#N)c[nH]3)c(C3=CCCCC3)c2)CC1 ZINC000038226716

ZINC000038226716 (search)

Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCN(CCO)CC2)n1 ZINC000003986735

ZINC000003986735 (search)

Nc1nc(N)c2nc(-c3cccc(O)c3)c(-c3cccc(O)c3)nc2n1 ZINC000006718666

ZINC000006718666 (search)

CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)ccn1 ZINC000001493878

ZINC000001493878 (search)

CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C ZINC000003916214

ZINC000003916214 (search)

COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC ZINC000006745792

ZINC000006745792 (search)

COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1 ZINC000003948085

ZINC000003948085 (search)

CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)ncc(OC[C@H]3CCCNC3)c21 ZINC000034285211

ZINC000034285211 (search)

CCOCCCn1c(S)nc2cc(C(=O)NC[C@H]3COc4ccccc4O3)ccc2c1=O ZINC000002972158

ZINC000002972158 (search)

O=C(CNC(=O)c1ccc(Oc2ccccc2)cc1)N[C@H]1CCCc2ccccc21 ZINC000003418215

ZINC000003418215 (search)

COc1ccc2nc(NC(=O)COC(=O)C[C@H](NC(=O)c3ccccc3)c3ccccc3)sc2c1 ZINC000003666585

ZINC000003666585 (search)

CCCCOc1ccc(C(=O)NCC(=O)N[C@@H]2CCCc3ccccc32)cc1 ZINC000008084022

ZINC000008084022 (search)

O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)N[C@@H]1CCCc2ccccc21 ZINC000029687898

ZINC000029687898 (search)

COc1ccc2nc(NC(=O)CNC(=O)Cn3cnc4sc(C)c(C)c4c3=O)sc2c1 ZINC000034138901

ZINC000034138901 (search)

Cc1cc(C(=O)NCC(=O)N[C@@H]2CCCc3ccccc32)cc(C)c1OCc1ccccc1 ZINC000036410531

ZINC000036410531 (search)

CCc1ccc(-c2ccc(C(=O)N[C@@H](C)C(=O)N[C@@H]3CCc4ccccc4C3)cc2)cc1 ZINC000036425703

ZINC000036425703 (search)

O=C(COc1ccc(Br)cc1)NCC(=O)N[C@H]1CCCc2ccccc21 ZINC000038309051

ZINC000038309051 (search)

CCc1ccc(-c2ccc(C(=O)NCC(=O)N[C@@H]3CCCc4ccccc43)cc2)cc1 ZINC000038346686

ZINC000038346686 (search)

CCc1ccc(-c2ccc(C(=O)NCC(=O)N[C@H]3CCCc4ccccc43)cc2)cc1 ZINC000038346687

ZINC000038346687 (search)

C[C@H](NC(=O)c1ccc(OCc2ccccc2)cc1)C(=O)N[C@@H]1CCc2ccccc2C1 ZINC000038347084

ZINC000038347084 (search)

CCCCCCCOc1ccc(C(=O)NCC(=O)N[C@@H]2CCCc3ccccc32)cc1 ZINC000135764634

ZINC000135764634 (search)

CCCCCOc1ccc(C(=O)N[C@@H](C)C(=O)N[C@@H]2CCc3ccccc3C2)cc1 ZINC000135766720

ZINC000135766720 (search)

COc1ccc(/C=C/C(=O)N2Cc3[nH]cnc3C[C@@H]2C(=O)NCCc2cccc(Cl)c2)cc1OC ZINC000135864299

ZINC000135864299 (search)

COc1ccc(/C=C/C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H]2CCCc3ccccc32)cc1OC ZINC000136530036

ZINC000136530036 (search)

CCCCOc1ccc(NC(=O)N[C@@H](COCc2ccccc2)C(=O)NCCc2ccccc2)cc1 ZINC000136618391

ZINC000136618391 (search)

CCCCCCCc1ccc(C(=O)NCC(=O)N[C@@H]2CCCc3ccccc32)cc1 ZINC000136823687

ZINC000136823687 (search)

CCCCCCOc1ccc(C(=O)NCC(=O)N[C@@H]2CCCc3ccccc32)cc1 ZINC000136827118

ZINC000136827118 (search)

CCCCCc1ccc(C(=O)NCC(=O)N[C@@H]2CCCc3ccccc32)cc1 ZINC000136970536

ZINC000136970536 (search)

O=C(N[C@@H]1CCCc2ccccc21)[C@@H](NC(=O)[C@@H](c1ccccc1)C1CCCC1)c1cccnc1 ZINC000137090499

ZINC000137090499 (search)

O=C(COc1ccc(OCc2ccccc2)cc1)NCC(=O)N[C@@H]1CCCc2ccccc21 ZINC000137701625

ZINC000137701625 (search)

CCCCOc1ccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H]2CCCc3ccccc32)cc1 ZINC000137783630

ZINC000137783630 (search)

CCCCCOc1ccc(C(=O)NCC(=O)N[C@@H]2CCCc3ccccc32)cc1 ZINC000139455356

ZINC000139455356 (search)

CCCCCCc1ccc(C(=O)NCC(=O)N[C@@H]2CCCc3ccccc32)cc1 ZINC000141521651

ZINC000141521651 (search)

CCCCOc1ccc(C(=O)N[C@@H](C)C(=O)N[C@@H]2CCc3ccccc3C2)cc1 ZINC000141532502

ZINC000141532502 (search)

O=C(NC[C@@H]1COc2ccccc2O1)c1ccc2c(c1)NC(=O)c1ccccc1N2 ZINC000143754815

ZINC000143754815 (search)

O=C(N[C@H](C(=O)N[C@@H]1CCCc2ccccc21)c1cccnc1)c1ccc(/N=N/c2ccccc2)cc1 ZINC000148552221

ZINC000148552221 (search)

O=C(N[C@H](C(=O)N[C@@H]1CCCc2ccccc21)c1cccnc1)c1ccc(-n2cncn2)cc1 ZINC000148664435

ZINC000148664435 (search)

O=C(CNC(=O)c1ccc(-n2ccnc2)cc1)N[C@@H]1CCCc2ccccc21 ZINC000148813284

ZINC000148813284 (search)

O=C(CNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21 ZINC000148827912

ZINC000148827912 (search)

O=C(CNC(=O)c1ccc(C2CCCCC2)cc1)N[C@@H]1CCCc2ccccc21 ZINC000148834126

ZINC000148834126 (search)

CCc1ccc(-c2ccc(C(=O)NCC(=O)NCc3ccccc3C(F)(F)F)cc2)cc1 ZINC000148850303

ZINC000148850303 (search)

O=C(CNC(=O)c1ccc(-c2cnco2)cc1)N[C@@H]1CCCc2ccccc21 ZINC000148871365

ZINC000148871365 (search)

COc1cc2cc(C(=O)NCC(=O)N[C@@H]3CCCc4ccccc43)[nH]c2cc1OC ZINC000148871811

ZINC000148871811 (search)

CCc1ccc(-c2ccc(C(=O)NCC(=O)NCc3ccccc3C)cc2)cc1 ZINC000148879356

ZINC000148879356 (search)

CCCCCCOc1ccc(C(=O)N[C@@H](C)C(=O)N[C@@H]2CCc3ccccc3C2)cc1 ZINC000148952998

ZINC000148952998 (search)

O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)NCC(=O)Nc1nccs1 ZINC000148957398

ZINC000148957398 (search)

O=C(CNC(=O)c1ccc(N2CCCCC2)cc1)N[C@@H]1CCCc2ccccc21 ZINC000148991598

ZINC000148991598 (search)

O=C(CNC(=O)c1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCc2ccccc21 ZINC000149037988

ZINC000149037988 (search)

COc1ccc2nc(NC(=O)CCCNC(=O)Cn3cnc4sc5c(c4c3=O)CCCC5)sc2c1 ZINC000149064463

ZINC000149064463 (search)

CCc1ccc(-c2ccc(C(=O)NCC(=O)N[C@@H](C)c3ccccc3)cc2)cc1 ZINC000149137507

ZINC000149137507 (search)

O=C(CNC(=O)c1ccc2ncccc2c1)N[C@@H]1CCCc2ccccc21 ZINC000149156556

ZINC000149156556 (search)

O=C(CN1CCN(S(=O)(=O)CCc2cccc3ccccc23)CC1)Nc1ccccn1 ZINC000149191965

ZINC000149191965 (search)

O=C(CNC(=O)c1ccc(O)cc1)N[C@@H]1CCCc2ccccc21 ZINC000149263411

ZINC000149263411 (search)

O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)NCC(=O)Nc1nc2ccc(O)cc2s1 ZINC000149267803

ZINC000149267803 (search)

CCc1ccc(-c2ccc(C(=O)NCC(=O)N[C@H](CC)c3ccccc3)cc2)cc1 ZINC000149285671

ZINC000149285671 (search)

CCc1ccc(-c2ccc(C(=O)NCC(=O)Nc3cccc4ccccc34)cc2)cc1 ZINC000149405654

ZINC000149405654 (search)

COc1ccc2nc(NC(=O)CNC(=O)C[C@@H](NC(=O)c3ccccc3)c3ccccc3)sc2c1 ZINC000149419798

ZINC000149419798 (search)

COc1ccc2nc(NC(=O)CNC(=O)C[C@@H](NC(=O)c3ccccc3)c3ccccc3)sc2n1 ZINC000149437317

ZINC000149437317 (search)

O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)NCC(=O)Nc1nc2ccccc2s1 ZINC000149440311

ZINC000149440311 (search)

CCCCc1ccc(NC(=O)N2CCC[C@@]2(N)C(=O)NCc2ccc(Cl)c(Cl)c2)cc1 ZINC000200150384

ZINC000200150384 (search)

COc1cccc(OCC(=O)NCC(=O)N[C@@H]2CCCc3ccccc32)c1 ZINC000200150442

ZINC000200150442 (search)

CC(C)c1ccc(NC(=O)N2CCC[C@@]2(N)C(=O)NCc2ccc(Cl)c(Cl)c2)cc1 ZINC000200150614

ZINC000200150614 (search)

O=C(CNC(=O)Nc1ccc(-c2ccccc2)cc1)N[C@@H]1CCCc2ccccc21 ZINC000200150678

ZINC000200150678 (search)

CCCCCOc1ccc(C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCc3ccccc32)cc1 ZINC000200151201

ZINC000200151201 (search)

O=C(CNC(=O)COc1ccc(Br)cc1)NCc1ccc(Cl)c(Cl)c1 ZINC000200151346

ZINC000200151346 (search)

COc1ccc(/C=C/C(=O)N[C@@H](COCc2ccccc2)C(=O)NC(c2ccccc2)c2ccccc2)cc1OC ZINC000200151868

ZINC000200151868 (search)

COc1cc2c(cc1OC)N[C@@H](C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)N[C@H]1CCCc3ccccc31)C2 ZINC000653671942

ZINC000653671942 (search)

O=C(COc1ccc(-c2ncc(-c3ccccn3)cn2)cc1)NCc1ccc(Cl)c(Cl)c1 ZINC000653684241

ZINC000653684241 (search)

O=C(CNC(=O)c1ccc2ccccc2c1)N[C@@H]1CCCc2ccccc21 ZINC000031483491

ZINC000031483491 (search)

O=C(CNC(=O)c1ccc(N2CCOCC2)cc1)N[C@@H]1CCCc2ccccc21 ZINC000148557671

ZINC000148557671 (search)

CC(C)C[C@@H](NC(=O)c1ccc(-c2ccccc2)cc1)C(=O)N[C@@H]1CCCc2ccccc21 ZINC000148728343

ZINC000148728343 (search)

CCc1ccc(-c2ccc(C(=O)NCC(=O)N[C@@H]3CNCc4ccccc43)cc2)cc1 ZINC000148733184

ZINC000148733184 (search)

CCCCc1ccc(C(=O)NCC(=O)N[C@@H]2CCCc3ccccc32)cc1 ZINC000149104080

ZINC000149104080 (search)

O=C(CNC(=O)c1ccc2c(c1)CCCC2)N[C@@H]1CCCc2ccccc21 ZINC000149171865

ZINC000149171865 (search)

CCc1ccc(-c2ccc(C(=O)NCC(=O)N[C@@H]3CN(C(=O)OC(C)(C)C)Cc4ccccc43)cc2)cc1 ZINC000149247939

ZINC000149247939 (search)

O=C(COc1ccc(Cl)cc1)NCC(=O)N[C@H]1CCCc2ccccc21 ZINC000200150520

ZINC000200150520 (search)

O=C(COc1ccc(OC(F)(F)F)cc1)NCC(=O)N[C@H]1CCCc2ccccc21 ZINC000200150775

ZINC000200150775 (search)

CC(C)(C)c1ccc(OCC(=O)NCC(=O)N[C@H]2CCCc3ccccc32)cc1 ZINC000653663960

ZINC000653663960 (search)