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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03000401

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LJGN,N'-(iminodiethane-2,1-diyl)bis[4-
amino-N-(2-methylpropyl)benzenesulfonamide]
B3BGB0.79
4NDN4-(N,N-DIPHENYLCARBAMOYL)-AMINOGUANIDINEH,I1NO90.72
ETP3-(4-BENZENESULFONYL-THIOPHENE-
2-SULFONYLAMINO)-PHENYLBORONIC ACID
A,B1GA90.7
TF2(N-{4-[(ETHYLANILINO)SULFONYL]-
2-METHYLPHENYL}-3,3,3-TRIFLUORO-
2-HYDROXY-2-METHYLPROPANAMIDE
A2BU60.71
LJHN,N'-(iminodiethane-2,1-diyl)bis(4-
amino-N-benzylbenzenesulfonamide)
A,B3BGC0.73
MPX4-({[(4-METHYLPIPERAZIN-1-YL)AMINO]CARBONOTHIOYL}AMINO)BENZENESULFONAMIDEA1ZH90.78
NR2N-({[4-(AMINOSULFONYL)PHENYL]AMINO}CARBONYL)-
4-METHYLBENZENESULFONAMIDE
A1ZFK0.9
ROK4-AMINO-N-[(2-SULFANYLETHYL)CARBAMOYL]BENZENESULFONAMIDEA,B,C,D,E,F,
G,H
2VT50.82
URSN-PHENYLTHIOUREAA,B1BUG0.74
TRU6-CHLORO-3-(DICHLOROMETHYL)-3,4-
DIHYDRO-2H-1,2,4-BENZOTHIADIAZINE-
7-SULFONAMIDE 1,1-DIOXIDE
A1ZGF0.71
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.78
CIUN-CYCLOHEXYL-N'-(4-IODOPHENYL)UREAA,B1EK10.75
CIUN-CYCLOHEXYL-N'-(4-IODOPHENYL)UREAA1VJ50.75
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2W4O0.75
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A3HMI0.75
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2J510.75
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2CHL0.75
DKI5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-
N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-
TRIAZOLE-1-CARBOTHIOAMIDE
A2JFL0.75
BOSN-[4-(AMINOSULFONYL)PHENYL]-2-MERCAPTOBENZAMIDEA2HD60.76
PHJN-[(AMINOOXY)CARBONYL]-N-PHENYLAMINEA,B1UR90.72
MNS5-(DIMETHYLAMINO)-1-NAPHTHALENESULFONAMIDEA1OKL0.71
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
SANSULFANILAMIDEA1AJ00.79
PL01-phenylguanidineA2O8W0.72
G3GN,N'-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(4-
AMINO-N-BENZYLBENZENESULFONAMIDE)
A,B2R430.7
G3GN,N'-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(4-
AMINO-N-BENZYLBENZENESULFONAMIDE)
A,B2PWC0.7
G3GN,N'-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(4-
AMINO-N-BENZYLBENZENESULFONAMIDE)
A,B2R3W0.7
OSPSULTHIAMEA2Q1Q0.8
AAS3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDEA1CZM0.77
TK42-ACETYLAMINO-NAPTHALENE-1,5-DISULFONIC ACIDH,L1C5C0.71