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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02359680

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
T2D1,2,5-THIADIAZOLIDIN-3-ONE-1,1-
DIOXIDE
A2BGE0.7
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA1S6R0.7
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA,B1K6S0.7
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2W4O0.7
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A3HMI0.7
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2J510.7
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2CHL0.7
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2JFL0.7
PL01-phenylguanidineA2O8W0.9
IDMINDOLINEA,B3CEP0.71
IDMINDOLINEA1AEK0.71
BSU1,3-DIPHENYLUREAA3E850.81
BSU1,3-DIPHENYLUREAA2ZJF0.81
CIUN-CYCLOHEXYL-N'-(4-IODOPHENYL)UREAA,B1EK10.74
CIUN-CYCLOHEXYL-N'-(4-IODOPHENYL)UREAA1VJ50.74
PH3N-(CHLOROPHENYL)-N'-HYDROXYGUANIDINEA,B1DM60.78
264(phenylamino)acetonitrileA2RBN0.76
RJ1N-[2-chloro-5-(trifluoromethyl)phenyl]imidodicarbonimidic diamideA,B,C,D3DGA0.74
NYLN-ALLYL-ANILINEA1OVK0.76
427(R)-1-(4-(4-(HYDROXYMETHYL)-1,3,2-
DIOXABOROLAN-2-YL)PHENYL)GUANIDINE
A1ZMN0.8
4NDN4-(N,N-DIPHENYLCARBAMOYL)-AMINOGUANIDINEH,I1NO90.79
U134-(4-FLUORO-PHENYLAZO)-5-IMINO-
5H-PYRAZOL-3-YLAMINE
A2GG30.71
CLU2,6-DICHLORO-N-IMIDAZOLIDIN-2-YLIDENEANILINEA,B,D,E2PNC0.71
ANLANILINEA2OV40.71
ANLANILINEA1AEE0.71
ANLANILINEA1PPA0.71
ANLANILINEA1HJ90.71
URSN-PHENYLTHIOUREAA,B1BUG0.81
ZAT4,4'-DIACETYLDIPHENYLUREA-BIS(GUANYLHYDRAZONE)A2W0J0.71
1MRN-METHYLANILINEX2OTZ0.76
PHJN-[(AMINOOXY)CARBONYL]-N-PHENYLAMINEA,B1UR90.73