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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02595187

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
5AN3,5-DIFLUOROANILINEA1LGX0.75
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.7
RJ1N-[2-chloro-5-(trifluoromethyl)phenyl]imidodicarbonimidic diamideA,B,C,D3DGA0.7
CIUN-CYCLOHEXYL-N'-(4-IODOPHENYL)UREAA,B1EK10.78
CIUN-CYCLOHEXYL-N'-(4-IODOPHENYL)UREAA1VJ50.78
1MRN-METHYLANILINEX2OTZ0.77
BSU1,3-DIPHENYLUREAA3E850.87
BSU1,3-DIPHENYLUREAA2ZJF0.87
4NDN4-(N,N-DIPHENYLCARBAMOYL)-AMINOGUANIDINEH,I1NO90.73
1AN2-FLUOROANILINEA1LGW0.75
PL01-phenylguanidineA2O8W0.81
ANLANILINEA2OV40.71
ANLANILINEA1AEE0.71
ANLANILINEA1PPA0.71
ANLANILINEA1HJ90.71
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA1S6R0.71
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA,B1K6S0.71
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2W4O0.71
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A3HMI0.71
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2J510.71
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2CHL0.71
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2JFL0.71
PH3N-(CHLOROPHENYL)-N'-HYDROXYGUANIDINEA,B1DM60.71
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.7
NYLN-ALLYL-ANILINEA1OVK0.77
URSN-PHENYLTHIOUREAA,B1BUG0.9
264(phenylamino)acetonitrileA2RBN0.77
PHJN-[(AMINOOXY)CARBONYL]-N-PHENYLAMINEA,B1UR90.73