BindingDB logo
myBDB logout

204 SMILES Strings for Aldo-keto reductase family 1 member C1

Compound NameSMILES String
BDBM150758 Oc1ccccc1-c1cc(=O)c2ccccc2o1
BDBM17638 COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1
BDBM17636 OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F
BDBM22971 Cc1ccc(Cl)c(Nc2ccccc2C(O)=O)c1Cl
BDBM26269 OC(=O)c1cc(Cl)cc(Cl)c1O
BDBM34643 OC(=O)CCNc1cc2ccccc2cc1C(O)=O
BDBM50000766 CN1c2ccc(Cl)cc2C(=NCC1=O)c1ccccc1 |c:10|
BDBM50029207 Oc1ccc(\C=C\C(=O)OCCc2ccccc2)cc1O
BDBM50067678 C[C@H]1C[C@H]2[C@@H]3CC[C@](OC(C)=O)(C(C)=O)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12 |r,t:28|
BDBM50074922 CC(C(O)=O)c1ccc(c(F)c1)-c1ccccc1
BDBM50134036 Cc1cccc(Nc2ccccc2C(O)=O)c1C
BDBM50158460 CCc1oc2ccccc2c1C(=O)c1cc(Br)c(O)c(Br)c1
BDBM50169047 CC(C)Cc1ccc(cc1)[C@H](C)C(O)=O |r|
BDBM50219490 OC(=O)c1cc(cc(Br)c1O)-c1ccccc1
BDBM50240769 OC(=O)c1cc(Br)cc(c1O)-c1ccccc1
BDBM50249792 OC(=O)c1cc(Br)cc(Br)c1O
BDBM50249793 Oc1c(Br)cc(cc1Br)C1(OC(=O)c2ccccc12)c1cc(Br)c(O)c(Br)c1
BDBM50293435 Clc1ccc(C=C2CCCC2=O)cc1 |w:5.4|
BDBM50293436 CCOC1CCC\C1=C/c1ccc(Cl)cc1
BDBM50293437 OC(=O)C1CCC(C1)c1ccccc1
BDBM50293438 OC(=O)C1(CCCC1)c1ccccc1
BDBM50293598 COc1ccc2n(cc(CC(O)=O)c2c1)C(=O)c1ccc(Cl)cc1
BDBM50339185 COc1ccc2cc(ccc2c1)[C@H](C)C(O)=O |r|
BDBM50330423 CC(C)(C)c1ccc(cc1)-c1cc(Cl)c(O)c(c1)C(O)=O
BDBM50330424 OC(=O)c1cc(cc(Cl)c1O)-c1ccc(OC(F)(F)F)cc1
BDBM50330430 COC(C)c1ccc(cc1)-c1cc(Cl)c(O)c(c1)C(O)=O
BDBM50330431 CCCCc1ccc(cc1)-c1cc(Cl)c(O)c(c1)C(O)=O
BDBM50330432 CC(C)Cc1ccc(cc1)-c1cc(Cl)c(O)c(c1)C(O)=O
BDBM50337281 OC(=O)c1cccc(Nc2ccc(cc2)[N+]([O-])=O)c1
BDBM50337282 CC(=O)c1ccc(Nc2cccc(c2)C(O)=O)cc1
BDBM50337283 OC(=O)c1cccc(Nc2ccc(cc2)C(F)(F)F)c1
BDBM50337284 OC(=O)c1cccc(Nc2ccc(Cl)cc2)c1
BDBM50337285 OC(=O)c1cccc(Nc2ccc(Br)cc2)c1
BDBM50337286 CC(C)(C)c1ccc(Nc2cccc(c2)C(O)=O)cc1
BDBM50330425 OC(=O)c1cc(cc(Cl)c1O)C#Cc1ccccc1
BDBM50330426 OC(=O)c1cc(cc(F)c1O)-c1ccccc1
BDBM50330427 OC(=O)c1cc(cc(Cl)c1O)-c1ccccc1
BDBM50330428 Cc1cccc(c1)-c1cc(Cl)c(O)c(c1)C(O)=O
BDBM50330429 Cc1ccc(cc1)-c1cc(Cl)c(O)c(c1)C(O)=O
BDBM50374770 CS(=O)(=O)c1ccc(\C=C(\C(O)=O)c2ccc(F)cc2)cc1
BDBM50374772 CS(=O)(=O)c1ccc(\C=C(\C(O)=O)c2ccccc2)cc1
BDBM50382163 OC(=O)c1cccc(Nc2ccc([N+]([O-])=O)c3ccccc23)c1
BDBM50390658 COc1cc(NC(=O)c2cccc(O)c2)c(cc1OC)C(O)=O
BDBM50390659 OC(=O)c1cc(ccc1NC(=O)c1cccc(O)c1)[N+]([O-])=O
BDBM50390656 OC(=O)c1ccccc1NC(=O)c1cccc(O)c1
BDBM50390657 OC(=O)c1cc(Cl)ccc1NC(=O)c1cccc(O)c1
BDBM50390660 OC(=O)c1cc(Br)ccc1NC(=O)c1cccc(O)c1
BDBM50390661 OC(=O)c1cc(Br)ccc1NC(=O)c1ccc(F)c(c1)[N+]([O-])=O
BDBM50390662 CCOc1cccc(c1)C(=O)Nc1ccc(Br)cc1C(O)=O
BDBM50390663 CCCCOc1cccc(c1)C(=O)Nc1ccc(Br)cc1C(O)=O
BDBM50390664 CCCCOc1cc(ccc1[N+]([O-])=O)C(=O)Nc1ccccc1C(O)=O
BDBM50384946 [#6]\[#6](-[#6])=[#6]/[#6]-c1cc(\[#6]=[#6]\[#6](-[#8])=O)ccc1-[#8]-[#6](=O)-[#6]-[#6]-c1ccccc1
BDBM50385686 CC(=O)c1ccc(Nc2cccc(c2)C(O)=O)c(c1)C(O)=O
BDBM50385687 OC(=O)c1cccc(Nc2ccc(cc2[N+]([O-])=O)C(F)(F)F)c1
BDBM50385688 COc1ccc(Nc2cccc(c2)C(O)=O)c(c1)[N+]([O-])=O
BDBM50396747 Cc1oc(cc1COc1ccccc1C(N)=O)C(N)=O
BDBM50396748 O=C1CCC2(Nc3ccccc3N12)c1ccccc1
BDBM50396675 OC(=O)c1cccc(c1)S(=O)(=O)N1CCC=CC1 |c:16|
BDBM50396718 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccc(cc2C1)C#N
BDBM50396719 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccc(I)cc2C1
BDBM50396720 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2cc(I)ccc2C1
BDBM50396721 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2cc(ccc2C1)C#N
BDBM50396722 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2c(O)cccc2C1
BDBM50396644 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccc(Cl)cc2C1
BDBM50396645 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccc(F)cc2C1
BDBM50396646 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccc(cc2C1)[N+]([O-])=O
BDBM50396647 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccc(cc2C1)-c1nnn[nH]1
BDBM50396648 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccc(cc2C1)C#Cc1ccc(OC(F)(F)F)cc1
BDBM50396649 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccc(cc2C1)C#C
BDBM50396650 Cc1ccc2CCN(Cc2c1)S(=O)(=O)c1cccc(c1)C(O)=O
BDBM50396651 COc1ccc2CN(CCc2c1)S(=O)(=O)c1cccc(c1)C(O)=O
BDBM50396652 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2cc(O)ccc2C1
BDBM50396653 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2cc(Br)ccc2C1
BDBM50396654 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2cc(ccc2C1)[N+]([O-])=O
BDBM50396655 Cc1ccc2CN(CCc2c1)S(=O)(=O)c1cccc(c1)C(O)=O
BDBM50396656 COc1cccc2CN(CCc12)S(=O)(=O)c1cccc(c1)C(O)=O
BDBM50396657 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2c(I)cccc2C1
BDBM50396658 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2c(Br)cccc2C1
BDBM50396659 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2c(Cl)cccc2C1
BDBM50396660 Nc1cccc2CN(CCc12)S(=O)(=O)c1cccc(c1)C(O)=O
BDBM50396661 CC1Cc2ccccc2CN1S(=O)(=O)c1cccc(c1)C(O)=O
BDBM50396662 CC1N(CCc2ccccc12)S(=O)(=O)c1cccc(c1)C(O)=O
BDBM50396663 OC(=O)C(=O)Nc1cccc(c1)S(=O)(=O)N1CCc2ccccc2C1
BDBM50396664 OC(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1
BDBM50396665 OC(=O)c1cccc(c1)S(=O)(=O)NCCc1ccc(Cl)cc1
BDBM50396666 OC(=O)c1cccc(c1)S(=O)(=O)NCCc1cccc(Cl)c1
BDBM50396667 OC(=O)c1cccc(c1)S(=O)(=O)NCCc1ccccc1
BDBM50396668 COc1cc2CCN(Cc2cc1OC)S(=O)(=O)c1cccc(c1)C(O)=O
BDBM50396669 OC(=O)c1cn(c2ccccc12)S(=O)(=O)c1ccc(Br)cc1
BDBM50396670 OC(=O)c1cccc(c1)S(=O)(=O)Nc1ccc2ccccc2c1
BDBM50396671 OC(=O)c1cccc(c1)S(=O)(=O)N1CCCc2ccccc12
BDBM50396672 OC(=O)c1cccc(c1)S(=O)(=O)N1Cc2ccccc2C1
BDBM50396673 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccccc12
BDBM50396674 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2sccc2C1
BDBM50396691 CC\C=C/C[C@@H]1[C@@H](CC(O)=O)CCC1=O |r|
BDBM50396692 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccc(Br)cc2C1
BDBM50396693 O=S(=O)(N1CCc2ccccc2C1)c1cccc(c1)-c1nnn[nH]1
BDBM50396694 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2c(C1)cccc2[N+]([O-])=O
BDBM50396695 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2cc(Cl)ccc2C1
BDBM50396696 OC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)-c1cccc(c1)-c1ccccc1
BDBM50396697 OC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)-c1ccccc1Cl
BDBM50396698 OC(=O)c1ccn(n1)S(=O)(=O)c1ccc2ccccc2c1
BDBM50396699 OC(=O)C1CCN(C1)S(=O)(=O)c1ccc2ccccc2c1
BDBM50396700 O=C1CCCN1c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1
BDBM50396701 O=C(NCCc1ccncc1)c1cccc(c1)S(=O)(=O)N1CCc2ccccc2C1
BDBM50396702 O=C(N1CC2(COC2)C1)c1cccc(c1)S(=O)(=O)N1CCc2ccccc2C1
BDBM50396703 CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccccc2C1
BDBM50396704 CNC(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccccc2C1
BDBM50396705 CN(C)CCNC(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccccc2C1
BDBM50396706 O=C(N1CCSCC1)c1cccc(c1)S(=O)(=O)N1CCc2ccccc2C1
BDBM50396707 O=C(N1CCOCC1)c1cccc(c1)S(=O)(=O)N1CCc2ccccc2C1
BDBM50396708 NC(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccccc2C1
BDBM50396709 Cc1ccc(CCNS(=O)(=O)c2cccc(c2)C(O)=O)cc1
BDBM50396710 Cc1cccc(CCNS(=O)(=O)c2cccc(c2)C(O)=O)c1
BDBM50396711 OC(=O)c1cccc(c1)S(=O)(=O)NCCc1cccc(Oc2ccccc2)c1
BDBM50396712 COc1ccc(CCNS(=O)(=O)c2cccc(c2)C(O)=O)cc1
BDBM50396713 COc1cccc(CCNS(=O)(=O)c2cccc(c2)C(O)=O)c1
BDBM50396714 OC(=O)c1cccc(c1)S(=O)(=O)NCCc1ccccc1F
BDBM50396715 OC(=O)c1cncc(c1)S(=O)(=O)N1CCc2ccccc2C1
BDBM50396716 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2cccc(Cl)c2C1
BDBM50396717 COc1ccc2CCN(Cc2c1)S(=O)(=O)c1cccc(c1)C(O)=O
BDBM50396729 O=C(c1ccccc1)c1ccc2OCC(=O)NCc2c1
BDBM50396730 OC(=O)CCNS(=O)(=O)c1ccc2ccccc2c1
BDBM50396676 OC(=O)c1cccc(c1)S(=O)(=O)N1CCc2ccccc2C1
BDBM50396731 OC(=O)COc1ccc2c(c1)oc(=O)c1ccccc21
BDBM50396732 OC(=O)c1cc(nc2ccccc12)-c1cccc(O)c1
BDBM50396733 Cc1ccn(Cc2cc(C(O)=O)c3ccccc3n2)n1
BDBM50396734 CN(c1ccc(cc1)C(O)=O)S(=O)(=O)c1ccccc1
BDBM50396739 NC(=O)c1ccccc1\N=C\c1cccc(O)c1O
BDBM50396687 OC(=O)C1CCCN(C1)S(=O)(=O)c1ccc2cc3ccccc3cc2c1
BDBM50396688 OC(=O)C1CCCN(C1)S(=O)(=O)c1cccc(c1)-c1ccccc1Cl
BDBM50396689 OC(=O)[C@H]1CCCN(C1)S(=O)(=O)c1ccc2ccccc2c1 |r|
BDBM50396690 OC(=O)[C@@H]1CCCN(C1)S(=O)(=O)c1ccc2ccccc2c1 |r|
BDBM50396742 Cc1cc(C(=O)Nc2ccc(O)c(c2)C(O)=O)c(C)o1
BDBM50396744 O=C(CSc1ncnc2nc[nH]c12)Nc1ccccn1
BDBM50396745 CC(=O)Nc1ccc(cc1)C(C#N)c1ccccc1
BDBM50396746 O=CN1CCN(CC1)C(=O)c1ccc2ccccc2c1
BDBM50427619 COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(CCC(=O)NS(C)(=O)=O)c(C)c2c1
BDBM50427620 COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(CCC(O)=O)c(C)c2c1
BDBM50427621 COc1ccc2n(cc(CC(=O)NS(=O)(=O)C(F)(F)F)c2c1)C(=O)c1ccc(Cl)cc1
BDBM50427622 CCc1c(CCC(O)=O)n(C(=O)c2ccc(Cl)cc2)c2ccc(OC)cc12
BDBM50427624 COc1ccc2n(C(=O)c3ccc(Cl)cc3)c3CCC(Cc3c2c1)C(O)=O
BDBM50427625 COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CCC(O)=O)c2c1
BDBM50427626 COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)NS(=O)(=O)C(F)(F)F)c2c1
BDBM50427627 COc1ccc2n(C(=O)c3ccc(cc3)C(F)(F)F)c(C)c(CC(O)=O)c2c1
BDBM50427628 COc1ccc2n(C(=O)c3ccc(CCl)cc3)c(C)c(CC(O)=O)c2c1
BDBM50427629 COc1ccc2n(C(=O)c3ccc(C)cc3)c(C)c(CC(O)=O)c2c1
BDBM50430714 O[C@@H]1CCCN(C1)S(=O)(=O)c1ccc(cc1)N1CCCC1=O |r|
BDBM50430715 O[C@H]1CCCN(C1)S(=O)(=O)c1ccc(cc1)N1CCCC1=O |r|
BDBM50430716 C[C@H]1CCC[C@H](C)N1S(=O)(=O)c1ccc(cc1)N1CCCC1=O |r|
BDBM50430717 CC1CCN(CC1)S(=O)(=O)c1ccc(cc1)N1CCCC1=O
BDBM50430700 CC1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)(C)C)cc1
BDBM50430703 CC1CCCCN1S(=O)(=O)c1ccc(cn1)N1CCCC1=O
BDBM50430708 CC1CCCCN1S(=O)(=O)c1ccc(cc1)N1CCCCC1=O
BDBM50430709 CC1CCCCN1S(=O)(=O)c1ccc(cc1)N1CCC1=O
BDBM50430718 CC1CCCN(C1)S(=O)(=O)c1ccc(cc1)N1CCCC1=O
BDBM50430719 C[C@@H]1CCCCN1S(=O)(=O)c1ccc(cc1)N1CCCC1=O |r|
BDBM50430722 O=C1CCCN1c1ccc(cc1)S(=O)(=O)N1CCCCC1
BDBM50430723 CC1CCCCN1S(=O)(=O)c1ccc(cc1)N1CCCS1(=O)=O
BDBM50429329 CS(=O)(=O)c1ccc(\C=C(\C(O)=O)c2cccc(Cl)c2)cc1
BDBM50429331 CS(=O)(=O)c1ccc(\C=C(\C(O)=O)c2ccc(Cl)cc2)cc1
BDBM50429333 CC(=O)NS(=O)(=O)c1ccc(\C=C(\C(O)=O)c2ccccc2)cc1
BDBM50429330 CSc1ccc(\C=C(\C(O)=O)c2cccc(Cl)c2)cc1
BDBM50429332 CSc1ccc(\C=C(\C(O)=O)c2ccc(Cl)cc2)cc1
BDBM50429334 CSc1ccc(\C=C(\C(O)=O)c2ccccc2)cc1
BDBM50429337 OC(=O)C(=C\c1ccccc1)\c1ccccc1
BDBM50445994 Clc1ccc(cc1)N1CCN(CC1)C(=O)N1CCc2ccccc2C1
BDBM50445995 OCC(=O)N1CCN(CC1)C(=O)N1CCN(CC1)c1ccc(Cl)cc1
BDBM50445996 Clc1ccc(cc1)N1CC2CC1CN2C(=O)N1CCOCC1
BDBM50445997 Clc1ccc(cc1)N1CCN(CC1)C(=O)N1CCSCC1
BDBM50445998 Clc1ccc(cc1)N1CCN(CC1)C(=O)N1CCCCC1
BDBM50446013 Brc1ccc(nc1)N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446014 OCc1cc(Cl)ccc1N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446015 Cc1cc(Cl)ccc1N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446016 Clc1ccc(N2CCN(CC2)C(=O)N2CCOCC2)c(Cl)c1
BDBM50446017 Ic1ccc(cc1)N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446018 Brc1ccc(cc1)N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446019 Clc1ccc(cc1)N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446020 FC(F)(F)c1ccc(cc1)N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446021 Clc1ccc(cc1)C(=O)N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446022 Clc1ccc(CN2CCN(CC2)C(=O)N2CCOCC2)cc1
BDBM50446023 Clc1ccc(cn1)N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446024 [O-][N+](=O)c1ccc(cc1)N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446025 CS(=O)(=O)c1ccc(cc1)N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446026 COC(=O)c1ccc(cc1)N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446027 Fc1ccc(cc1)N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446028 O=C(N1CCOCC1)N1CCN(CC1)c1ccc(cc1)C#C
BDBM50446029 O=C(N1CCOCC1)N1CCN(CC1)c1cnc2ccccc2c1
BDBM50446030 O=C(N1CCOCC1)N1CCN(CC1)c1ccc2ccccc2c1
BDBM50446031 COc1ccc(cc1)N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446032 Cc1ccc(cc1)N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446033 Clc1cccc(c1)N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446034 FC(F)(F)c1ccccc1N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446035 Clc1ccccc1N1CCN(CC1)C(=O)N1CCOCC1
BDBM50446036 O=C(N1CCOCC1)N1CCN(CC1)c1ccccc1
BDBM50024764 OC(=O)\C=C\c1ccc(OC(=O)CCc2ccccc2)c(OCc2cccc(O)c2)c1
BDBM50024763 COc1cccc(COc2cc(\C=C\C(O)=O)ccc2OC(=O)CCc2ccccc2)c1
BDBM220117 OC(=O)c1cccc(Nc2ccc(cc2N(=O)=O)N(=O)=O)c1
BDBM220121 Clc1ccc2NC(=O)CN3CCOC3(c3ccccc3Cl)c2c1
BDBM220122 CC(=O)c1ccc(C(O)=O)c(Nc2ccccc2C(O)=O)c1
BDBM220123 OC(=O)c1ccccc1Nc1cc(ccc1N(=O)=O)C(F)(F)F
BDBM220124 COc1ccc(c(Nc2ccccc2C(O)=O)c1)N(=O)=O
BDBM220115 COC(=O)c1cccc(Nc2ccc([N+]([O-])=O)c3ccccc23)c1
BDBM220116 COc1ccc2n(cc(CNC(C)=O)c2c1)C(=O)c1ccc(Cl)cc1