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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03000402

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.74
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2W4O0.72
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A3HMI0.72
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2J510.72
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2CHL0.72
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2JFL0.72
BOSN-[4-(AMINOSULFONYL)PHENYL]-2-MERCAPTOBENZAMIDEA2HD60.72
MPX4-({[(4-METHYLPIPERAZIN-1-YL)AMINO]CARBONOTHIOYL}AMINO)BENZENESULFONAMIDEA1ZH90.74
TK42-ACETYLAMINO-NAPTHALENE-1,5-DISULFONIC ACIDH,L1C5C0.73
SANSULFANILAMIDEA1AJ00.75
4NDN4-(N,N-DIPHENYLCARBAMOYL)-AMINOGUANIDINEH,I1NO90.73
URSN-PHENYLTHIOUREAA,B1BUG0.75
NR2N-({[4-(AMINOSULFONYL)PHENYL]AMINO}CARBONYL)-
4-METHYLBENZENESULFONAMIDE
A1ZFK0.86
OSPSULTHIAMEA2Q1Q0.76
AAS3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDEA1CZM0.73
ROK4-AMINO-N-[(2-SULFANYLETHYL)CARBAMOYL]BENZENESULFONAMIDEA,B,C,D,E,F,
G,H
2VT50.78
BSU1,3-DIPHENYLUREAA3E850.84
BSU1,3-DIPHENYLUREAA2ZJF0.84
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA1S6R0.71
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA,B1K6S0.71
1712-PHENYLAMINO-ETHANESULFONIC ACIDA,B1SXG0.73
CIUN-CYCLOHEXYL-N'-(4-IODOPHENYL)UREAA,B1EK10.76
CIUN-CYCLOHEXYL-N'-(4-IODOPHENYL)UREAA1VJ50.76
PL01-phenylguanidineA2O8W0.72
LJGN,N'-(iminodiethane-2,1-diyl)bis[4-
amino-N-(2-methylpropyl)benzenesulfonamide]
B3BGB0.75
PHJN-[(AMINOOXY)CARBONYL]-N-PHENYLAMINEA,B1UR90.73