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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01243635

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1MRN-METHYLANILINEX2OTZ0.74
NBENITROSOBENZENEA1LH70.71
NBENITROSOBENZENEA2LH70.71
NBENITROSOBENZENEA2NSS0.71
I7B4-AMINO-6-CHLOROBENZENE-1,3-DISULFONAMIDEA2POV0.78
MNS5-(DIMETHYLAMINO)-1-NAPHTHALENESULFONAMIDEA1OKL0.7
MB12-chloro-5-nitrobenzenesulfonamideA2QP60.73
SBN2-AMINO-6-(3,5-DIMETHYLPHENYL)SULFONYLBENZONITRILEA1JLQ0.71
I7C4-AMINO-6-(TRIFLUOROMETHYL)BENZENE-
1,3-DISULFONAMIDE
A2POW0.77
LJGN,N'-(iminodiethane-2,1-diyl)bis[4-
amino-N-(2-methylpropyl)benzenesulfonamide]
B3BGB0.81
ZYX4-(2-AMINOETHYL)BENZENESULFONAMIDEA2NNG0.73
ROK4-AMINO-N-[(2-SULFANYLETHYL)CARBAMOYL]BENZENESULFONAMIDEA,B,C,D,E,F,
G,H
2VT50.83
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.79
SDA4-AMINO-3,5-DICHLOROBENZENESULFONAMIDEA1ZGE0.79
CS1S-(2-ANILINYL-SULFANYL)-CYSTEINEA,B2OMA0.72
AAS3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDEA1CZM0.88
1AN2-FLUOROANILINEA1LGW0.74
LJHN,N'-(iminodiethane-2,1-diyl)bis(4-
amino-N-benzylbenzenesulfonamide)
A,B3BGC0.72
N2M5-AMINO-NAPHTALENE-2-MONOSULFONATEC,D1HKN0.7
NYLN-ALLYL-ANILINEA1OVK0.71
1712-PHENYLAMINO-ETHANESULFONIC ACIDA,B1SXG0.76
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.73
5AN3,5-DIFLUOROANILINEA1LGX0.72
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.95
PHZ1-PHENYLHYDRAZINEA2E2T0.73
PHZ1-PHENYLHYDRAZINED,H2AGL0.73
PTU2-ETHYL-1-PHENYL-ISOTHIOUREAA,B1K2T0.71
PTU2-ETHYL-1-PHENYL-ISOTHIOUREAA,B1D1V0.71
ETP3-(4-BENZENESULFONYL-THIOPHENE-
2-SULFONYLAMINO)-PHENYLBORONIC ACID
A,B1GA90.73
SANSULFANILAMIDEA1AJ00.96
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.73
PRY2-PROPYL-ANILINEA1OWY0.71
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.79
5NS5-aminonaphthalene-1-sulfonic acidA,B3CFT0.7
NHP4-(2-AMINOPHENYLTHIO)-BUTYLPHOSPHONIC ACIDA,B1CX90.71
NIT4-NITROANILINEC,D1RMH0.72
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.72
NIT4-NITROANILINEB1VBS0.72
NIT4-NITROANILINEC1V9T0.72
NIT4-NITROANILINEC,D1VBT0.72
NIT4-NITROANILINEB1LOP0.72
NIT4-NITROANILINEC,D1ZKF0.72
NIT4-NITROANILINEB1PIP0.72
OSPSULTHIAMEA2Q1Q0.79
ANLANILINEA2OV40.76
ANLANILINEA1AEE0.76
ANLANILINEA1PPA0.76
ANLANILINEA1HJ90.76
MPX4-({[(4-METHYLPIPERAZIN-1-YL)AMINO]CARBONOTHIOYL}AMINO)BENZENESULFONAMIDEA1ZH90.71
264(phenylamino)acetonitrileA2RBN0.7
UA5(4-ETHYLPHENYL)SULFAMIC ACIDA,B2I5X0.73
NR2N-({[4-(AMINOSULFONYL)PHENYL]AMINO}CARBONYL)-
4-METHYLBENZENESULFONAMIDE
A1ZFK0.73
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D730.78
NBBN-BUTYL-BENZENESULFONAMIDEA3D770.78
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D780.78
NBBN-BUTYL-BENZENESULFONAMIDEA,B3CZ10.78
NBBN-BUTYL-BENZENESULFONAMIDEA3D750.78
NBBN-BUTYL-BENZENESULFONAMIDEA3D760.78
NBBN-BUTYL-BENZENESULFONAMIDEA3BJH0.78
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D740.78