SMILES for NEDD8-activating enzyme E1 catalytic subunit

100 SMILES Strings for NEDD8-activating enzyme E1 catalytic subunit

Compound Name

SMILES String

BDBM50601510

CC(C)(C)NC(=O)N1CCC2(C[C@H](Nc3ncnc4n(nnc34)[C@H]3C[C@H](O)[C@H](COS(N)(=O)=O)C3)c3ccccc23)CC1 |r|

BDBM50601505

CC(C)(C)OC(=O)N1CCC2(C[C@H](Nc3ncnc4n(nnc34)[C@H]3C[C@H](O)[C@H](COS(N)(=O)=O)C3)c3ccccc23)CC1 |r|

BDBM50601503

CC(C)OC(=O)N1CCC2(C[C@H](Nc3ncnc4n(nnc34)[C@H]3C[C@H](O)[C@H](COS(N)(=O)=O)C3)c3ccccc23)CC1 |r|

BDBM50575592

CC(N)(c1csc(c1)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1)c1cccc(Cl)c1 |r|

BDBM50575593

CC(O)(c1csc(c1)C(=O)c1cncnc1N[C@@H]1C[C@H](COS(N)(=O)=O)[C@@H](O)[C@H]1O)c1cccc(Br)n1 |r|

BDBM50575591

CC(O)(c1csc(c1)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1)c1cccc(Cl)c1 |r|

BDBM50601488

CCCCCCNc1ncnc2n(nnc12)[C@H]1C[C@H](O)[C@H](COS(N)(=O)=O)C1 |r|

BDBM50601501

CCOC(=O)N1CCC2(C[C@H](Nc3ncnc4n(nnc34)[C@H]3C[C@H](O)[C@H](COS(N)(=O)=O)C3)c3ccccc23)CC1 |r|

BDBM320991

CCOc1cccc(F)c1C#Cc1cn([C@@H]2O[C@H](CNS(N)(=O)=O)[C@@H](O)[C@H]2O)c2ncnc(N)c12

BDBM50601511

CCOc1cccc(F)c1C#Cc1cn([C@@H]2O[C@H](COS(N)(=O)=O)[C@@H](O)[C@H]2O)c2ncnc(N)c12 |r|

BDBM50318907

CCOc1nc2cccc(C(=O)OC(C)OC(=O)OC3CCCCC3)c2n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1

BDBM50575584

CN(C)C(c1csc(c1)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1)c1cccc(Cl)c1 |r|

BDBM50601495

CN(C)[C@H]1Cc2ccccc2[C@H]1Nc1ncnc2n(nnc12)[C@H]1C[C@H](O)[C@H](COS(N)(=O)=O)C1 |r|

BDBM50601500

CN1CCC2(C[C@H](Nc3ncnc4n(nnc34)[C@H]3C[C@H](O)[C@H](COS(N)(=O)=O)C3)c3ccccc23)CC1 |r|

BDBM50575607

CN1CCc2ccc(Cl)cc2C1c1csc(c1)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1 |r|

BDBM50575583

CNC(c1csc(c1)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1)c1cccc(Cl)c1 |r|

BDBM50594972

COC(=O)N1CCC2(C[C@H](Nc3ncnc4n(nnc34)[C@H]3C[C@H](O)[C@H](COS(N)(=O)=O)C3)c3ccccc23)CC1 |r|

BDBM50601490

COC(=O)[C@@H]1C[C@H](Nc2ncnc3n(nnc23)[C@H]2C[C@H](O)[C@H](COS(N)(=O)=O)C2)C=C1 |r,c:32|

BDBM50601509

COCC(=O)N1CCC2(C[C@H](Nc3ncnc4n(nnc34)[C@H]3C[C@H](O)[C@H](COS(N)(=O)=O)C3)c3ccccc23)CC1 |r|

BDBM50601498

COCC(=O)N[C@@H]1Cc2ccccc2[C@H]1Nc1ncnc2n(nnc12)[C@H]1C[C@H](O)[C@H](COS(N)(=O)=O)C1 |r|

BDBM50601497

COCC(=O)N[C@H]1Cc2ccccc2[C@H]1Nc1ncnc2n(nnc12)[C@H]1C[C@H](O)[C@H](COS(N)(=O)=O)C1 |r|

BDBM50601496

COCCO[C@H]1Cc2ccccc2[C@H]1Nc1ncnc2n(nnc12)[C@H]1C[C@H](O)[C@H](COS(N)(=O)=O)C1 |r|

BDBM50575569

Cc1cccc(Cn2ccc(n2)C(=O)c2cncnc2N[C@H]2C[C@H](O)[C@@H](COS(N)(=O)=O)C2)c1 |r|

BDBM50575588

Cc1sc(cc1C(N)c1cccc(Cl)c1)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1 |r|

BDBM50575586

Cc1sc(cc1C(O)c1cccc(Cl)c1)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1 |r|

BDBM50575594

Cc1sc(cc1C1OCCc2ccc(Cl)cc12)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1 |r|

BDBM50575601

Cc1sc(cc1C1OCCc2ccc(Cl)nc12)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1 |r|

BDBM50575599

Cc1sc(cc1C1OCCc2ccccc12)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1 |r|

BDBM50575600

Cc1sc(cc1C1OCCc2cccnc12)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1 |r|

BDBM462715

Cc1sc(cc1Cc1cccc(Cl)c1)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1

BDBM462958

Cc1sc(cc1[C@@H]1NCCc2ccc(Cl)cc12)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1

BDBM50575603

Cc1sc(cc1[C@H]1NCCc2ccc(Cl)cc12)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1 |r|

BDBM50575589

NC(c1cc(sc1Cl)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1)c1cccc(Cl)c1 |r|

BDBM50575582

NC(c1csc(c1)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1)c1cccc(Cl)c1 |r|

BDBM50601481

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)Nc1ncnc(N[C@H]2CCc3ccccc23)c1F |r|

BDBM50591768

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2cccc(Br)c2)n1 |r|

BDBM50575558

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2ccccc2)n1 |r|

BDBM50601480

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1ncc2c(N[C@H]3CCc4ccccc34)ccnc12 |r|

BDBM50601489

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(NC3CCCC3)ncnc12 |r|

BDBM50601487

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(NCCCc3ccccc3)ncnc12 |r|

BDBM50601485

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(NCCc3ccccc3)ncnc12 |r|

BDBM50601486

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(NCCc3cccs3)ncnc12 |r|

BDBM50601482

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(NCc3ccccc3F)ncnc12 |r|

BDBM50601483

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(NCc3ccco3)ncnc12 |r|

BDBM50601484

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(NCc3cccs3)ncnc12 |r|

BDBM50601504

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(N[C@H]3CC4(CCN(CC4)C(=O)OC(C(F)(F)F)C(F)(F)F)c4ccccc34)ncnc12 |r|

BDBM50601506

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(N[C@H]3CC4(CCN(CC4)C(=O)OC(CO)CO)c4ccccc34)ncnc12 |r|

BDBM50601502

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(N[C@H]3CC4(CCN(CC4)C(=O)OCCF)c4ccccc34)ncnc12 |r|

BDBM50601507

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(N[C@H]3CC4(CCN(CC4)C(=O)OCCN4CCOCC4)c4ccccc34)ncnc12 |r|

BDBM50601508

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(N[C@H]3CC4(CCN(CC4)C(=O)O[C@@H]4CCOC4)c4ccccc34)ncnc12 |r|

BDBM50601499

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(N[C@H]3CC4(CCNCC4)c4ccccc34)ncnc12 |r|

BDBM50601479

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(N[C@H]3CCc4ccccc34)ncnc12 |r|

BDBM50601494

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(N[C@H]3[C@@H](O)Cc4ccccc34)ncnc12 |r|

BDBM50601492

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(Nc3cnc4ccccn34)ncnc12 |r|

BDBM50601491

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(Nc3n[nH]c4ccccc34)ncnc12 |r|

BDBM50601493

NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1nnc2c(Nn3ccc4ccccc34)ncnc12 |r|

BDBM50575561

NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3ccccc3)n2)C(F)(F)[C@@H]1O |r|

BDBM50575560

NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3ccccc3)n2)[C@@H](F)[C@@H]1O |r|

BDBM50575557

NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3ccccc3)n2)[C@@H](O)[C@@H]1O |r|

BDBM50575559

NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3ccccc3)n2)[C@H](F)[C@@H]1O |r|

BDBM50575555

NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3ccccc3)n2)[C@H](O)[C@@H]1O |r|

BDBM50575587

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(C(O)c2cccc(Cl)c2)c(Cl)s1 |r|

BDBM50575590

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(C(O)c2cccc(Cl)n2)c(Cl)s1 |r|

BDBM50575604

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(C2NCCc3ccc(Cl)cc23)c(Cl)s1 |r|

BDBM50575595

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(C2OCCc3ccc(Cl)cc23)c(Cl)s1 |r|

BDBM50575602

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(C2OCc3ccc(Cl)cc23)c(Cl)s1 |r|

BDBM462725

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(Cc2cccc(Br)c2)cs1

BDBM462777

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(Cc2cccc(Cl)c2)c(Cl)s1

BDBM50575585

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(Cc2cccc(Cl)c2)c(s1)C#N |r|

BDBM462705

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(Cc2cccc(Cl)c2)cs1

BDBM50575581

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(cs1)C(O)c1cccc(Cl)c1 |r|

BDBM50575606

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(cs1)C1NCCc2ccc(Cl)cc12 |r|

BDBM50575605

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(cs1)C1NCCc2ccccc12 |r|

BDBM50575608

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(cs1)C1NCc2ccc(Cl)cc12 |r|

BDBM50575598

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(cs1)C1OCCc2c(Cl)cccc12 |r|

BDBM50575597

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(cs1)C1OCCc2ccc(Cl)cc12 |r|

BDBM50575596

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cc(cs1)[C@@H]1OCCc2ccccc12 |r|

BDBM462748

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccc(Cc2cccc(Br)c2)o1

BDBM50575563

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(CC2CCCCC2)n1 |r|

BDBM50575566

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2ccc(Cl)cc2)n1 |r|

BDBM50575573

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2ccc(Cl)o2)n1 |r|

BDBM50575574

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2ccc(Cl)s2)n1 |r|

BDBM50575579

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2cccc(Br)c2)c1 |r|

BDBM50575568

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2cccc(Br)c2)n1 |r|

BDBM50575576

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2cccc(Br)n2)n1 |r|

BDBM50575565

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2cccc(Cl)c2)n1 |r|

BDBM50575575

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2cccc(Cl)n2)n1 |r|

BDBM50575567

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2cccc(F)c2)n1 |r|

BDBM50575572

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2cccc(OC(F)(F)F)c2)n1 |r|

BDBM50575570

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2cccc(c2)C#C)n1 |r|

BDBM50575571

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2cccc(c2)C(F)(F)F)n1 |r|

BDBM50575577

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2ccccc2)c1 |r|

BDBM50575556

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2ccccc2)n1 |r|

BDBM50575564

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(Cc2ccccc2Cl)n1 |r|

BDBM50575562

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1ccn(n1)-c1ccccc1 |r|

BDBM50575578

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1cnn(Cc2ccccc2)c1 |r|

BDBM50575580

NS(=O)(=O)OC[C@H]1C[C@H](C[C@@H]1O)Nc1ncncc1C(=O)c1csc(Cc2cccc(Br)c2)c1 |r|

BDBM50427035

NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@H]3CCc4ccccc34)ncnc12 |r|

BDBM67690

OCCNCCNc1ccc(NCCNCCO)c2C(=O)c3c(O)ccc(O)c3C(=O)c12

BDBM50285607

[H][C@]1(O)C[C@@]([H])(C[C@@]1([H])COS(N)(=O)=O)n1ccc2c(N[C@@]3([H])CCc4ccccc34)ncnc12 |r|