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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01243200

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PRY2-PROPYL-ANILINEA1OWY0.7
UA5(4-ETHYLPHENYL)SULFAMIC ACIDA,B2I5X0.71
SMLPHENYL METHYL SULFONEA,I1D6W0.7
SMLPHENYL METHYL SULFONEA,I1D9I0.7
I7C4-AMINO-6-(TRIFLUOROMETHYL)BENZENE-
1,3-DISULFONAMIDE
A2POW0.7
AAS3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDEA1CZM0.82
OSPSULTHIAMEA2Q1Q0.75
ANLANILINEA2OV40.74
ANLANILINEA1AEE0.74
ANLANILINEA1PPA0.74
ANLANILINEA1HJ90.74
SDA4-AMINO-3,5-DICHLOROBENZENESULFONAMIDEA1ZGE0.71
1712-PHENYLAMINO-ETHANESULFONIC ACIDA,B1SXG0.76
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.76
PVS(ethenylsulfonyl)benzeneA3BLU0.72
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.86
PTU2-ETHYL-1-PHENYL-ISOTHIOUREAA,B1K2T0.76
PTU2-ETHYL-1-PHENYL-ISOTHIOUREAA,B1D1V0.76
CS1S-(2-ANILINYL-SULFANYL)-CYSTEINEA,B2OMA0.7
SANSULFANILAMIDEA1AJ00.87
I7B4-AMINO-6-CHLOROBENZENE-1,3-DISULFONAMIDEA2POV0.71
LJGN,N'-(iminodiethane-2,1-diyl)bis[4-
amino-N-(2-methylpropyl)benzenesulfonamide]
B3BGB0.72
ROK4-AMINO-N-[(2-SULFANYLETHYL)CARBAMOYL]BENZENESULFONAMIDEA,B,C,D,E,F,
G,H
2VT50.77
SBN2-AMINO-6-(3,5-DIMETHYLPHENYL)SULFONYLBENZONITRILEA1JLQ0.77
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.76
1AN2-FLUOROANILINEA1LGW0.71
ETP3-(4-BENZENESULFONYL-THIOPHENE-
2-SULFONYLAMINO)-PHENYLBORONIC ACID
A,B1GA90.81
5BM(2Z)-bis{amino[(2-aminophenyl)sulfanyl]methylidene}butanedinitrileA3EQH0.73
NHP4-(2-AMINOPHENYLTHIO)-BUTYLPHOSPHONIC ACIDA,B1CX90.83
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.8