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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01529826

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.84
AAS3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDEA1CZM0.8
CS1S-(2-ANILINYL-SULFANYL)-CYSTEINEA,B2OMA0.73
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.7
I7C4-AMINO-6-(TRIFLUOROMETHYL)BENZENE-
1,3-DISULFONAMIDE
A2POW0.72
SANSULFANILAMIDEA1AJ00.85
I7B4-AMINO-6-CHLOROBENZENE-1,3-DISULFONAMIDEA2POV0.73
ROK4-AMINO-N-[(2-SULFANYLETHYL)CARBAMOYL]BENZENESULFONAMIDEA,B,C,D,E,F,
G,H
2VT50.82
NHP4-(2-AMINOPHENYLTHIO)-BUTYLPHOSPHONIC ACIDA,B1CX90.74
LJHN,N'-(iminodiethane-2,1-diyl)bis(4-
amino-N-benzylbenzenesulfonamide)
A,B3BGC0.7
SUA(4-SULFAMOYL-PHENYL)-THIOCARBAMIC ACID O-
(2-THIOPHEN-3-YL-ETHYL) ESTER
A1LUG0.71
AL5THIOPHENE-2,5-DISULFONIC ACID 2-
AMIDE-5-(4-METHYL-BENZYLAMIDE)
A1BN10.72
OSPSULTHIAMEA2Q1Q0.81
LJGN,N'-(iminodiethane-2,1-diyl)bis[4-
amino-N-(2-methylpropyl)benzenesulfonamide]
B3BGB0.77
1712-PHENYLAMINO-ETHANESULFONIC ACIDA,B1SXG0.74
ETP3-(4-BENZENESULFONYL-THIOPHENE-
2-SULFONYLAMINO)-PHENYLBORONIC ACID
A,B1GA90.83
SDA4-AMINO-3,5-DICHLOROBENZENESULFONAMIDEA1ZGE0.7
G3GN,N'-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(4-
AMINO-N-BENZYLBENZENESULFONAMIDE)
A,B2R430.72
G3GN,N'-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(4-
AMINO-N-BENZYLBENZENESULFONAMIDE)
A,B2PWC0.72
G3GN,N'-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(4-
AMINO-N-BENZYLBENZENESULFONAMIDE)
A,B2R3W0.72
TPDN-(2-THIENYLMETHYL)-2,5-THIOPHENEDISULFONAMIDEA1BNW0.73
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D730.7
NBBN-BUTYL-BENZENESULFONAMIDEA3D770.7
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D780.7
NBBN-BUTYL-BENZENESULFONAMIDEA,B3CZ10.7
NBBN-BUTYL-BENZENESULFONAMIDEA3D750.7
NBBN-BUTYL-BENZENESULFONAMIDEA3D760.7
NBBN-BUTYL-BENZENESULFONAMIDEA3BJH0.7
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D740.7