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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03160410

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MSB1-METHYLOXY-4-SULFONE-BENZENEA1EUB0.83
MSB1-METHYLOXY-4-SULFONE-BENZENEA1BM60.83
2612-ethoxyphenolX2RB10.7
DZG1-(2,3-dihydro-1,4-benzodioxin-
6-ylsulfonyl)-4-[(4-methoxyphenyl)sulfonyl]piperazine
A,B,C,D3GQY0.82
283(3S)-1-{[4-(BUT-2-YN-1-YLOXY)PHENYL]SULFONYL}PYRROLIDINE-
3-THIOL
A2OI00.9
258(2-chloroethoxy)benzeneX2RAY0.72
2682-phenoxyethanolA2RBR0.73
4403-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}propane-
1-thiol
A3B920.81
IH6(3S)-4-{[4-(BUT-2-YNYLOXY)PHENYL]SULFONYL}-
N-HYDROXY-2,2-DIMETHYLTHIOMORPHOLINE-
3-CARBOXAMIDE
A,B1ZXC0.73
F9F2-({[4-(TRIFLUOROMETHOXY)PHENYL]SULFONYL}AMINO)ETHYL DIHYDROGEN PHOSPHATEA,B2CLI0.79
F9F2-({[4-(TRIFLUOROMETHOXY)PHENYL]SULFONYL}AMINO)ETHYL DIHYDROGEN PHOSPHATEA,B2CLL0.79
4NH4-({4-[(4-AMINOBUT-2-YNYL)OXY]PHENYL}SULFONYL)-
N-HYDROXY-2,2-DIMETHYLTHIOMORPHOLINE-
3-CARBOXAMIDE
A,B2A8H0.72
INK(RP,SP)-O-(2R)-(1-PHENOXYBUT-2-
YL)-METHYLPHOSPHONIC ACID CHLORIDE
A1HQD0.72
FINA1ZVX0.7
DYY1-[(2,6-difluorophenyl)sulfonyl]-
4-(2,3-dihydro-1,4-benzodioxin-
6-ylsulfonyl)piperazine
A,B,C,D3GR40.79
HS12-[[(2S)-2,3-dihydroxypropyl]-(4-
methoxyphenyl)sulfonyl-amino]-N-
oxo-ethanamide
A3F150.79
NGHN-ISOBUTYL-N-[4-METHOXYPHENYLSULFONYL]GLYCYL HYDROXAMIC ACIDA,B,C1Q3A0.8
NGHN-ISOBUTYL-N-[4-METHOXYPHENYLSULFONYL]GLYCYL HYDROXAMIC ACIDA1YCM0.8
NGHN-ISOBUTYL-N-[4-METHOXYPHENYLSULFONYL]GLYCYL HYDROXAMIC ACIDA2JSD0.8
NGHN-ISOBUTYL-N-[4-METHOXYPHENYLSULFONYL]GLYCYL HYDROXAMIC ACIDA1Z3J0.8
NGHN-ISOBUTYL-N-[4-METHOXYPHENYLSULFONYL]GLYCYL HYDROXAMIC ACIDA2JNP0.8
NGHN-ISOBUTYL-N-[4-METHOXYPHENYLSULFONYL]GLYCYL HYDROXAMIC ACIDA1RMZ0.8
EPLDIETHYL 4-METHOXYPHENYL PHOSPHATEA2R1N0.7
POT(1S)-1-(PHENOXYMETHYL)PROPYL METHYLPHOSPHONOCHLORIDOATEA2NW60.72
EINA1ZS00.7
MLGN-[3-(2,4-DICHLOROPHENOXY)PROPYL]-
N-METHYL-N-PROP-2-YNYLAMINE
A,B2BXR0.7
MLGN-[3-(2,4-DICHLOROPHENOXY)PROPYL]-
N-METHYL-N-PROP-2-YNYLAMINE
A,B2BXS0.7
MLGN-[3-(2,4-DICHLOROPHENOXY)PROPYL]-
N-METHYL-N-PROP-2-YNYLAMINE
A,B,C,D1O5W0.7
CTX(Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)-
PHENOXY]-N,N-DIMETHYLETHANAMINE
A,B,C1YA40.7
GMN2,2',2"-[1,2,3-BENZENE-TRIYLTRIS(OXY)]TRIS[N,N,N-
TRIETHYLETHANAMINIUM]
A,B1N5M0.74
SPCN-HYDROXY 1N(4-METHOXYPHENYL)SULFONYL-
4-(Z,E-N-METHOXYIMINO)PYRROLIDINE-
2R-CARBOXAMIDE
A,B1D7X0.73
MM3N-HYDROXY-4-[(4-METHOXYLPHENYL)SULFONYL]-
2,2-DIMETHYL-HEXAHYDRO-1,4-THIAZEPINE-
3(S)-CARBOXAMIDE
A,B1D5J0.72
HS3(2R)-3-hydroxy-2-[(4-methoxyphenyl)sulfonylamino]-
N-oxo-propanamide
A3F160.74
8MR(3R)-4,4-DIFLUORO-3-[(4-METHOXYPHENYL)SULFONYL]BUTANOIC ACIDA,B2OW20.7
TBLN-[(4-methoxyphenyl)sulfonyl]-D-
alanine
A3EHY0.78
111(1N)-4-N-BUTOXYPHENYLSULFONYL-(2R)-
N-HYDROXYCARBOXAMIDO-(4S)-METHANESULFONYLAMINO-
PYRROLIDINE
A,B1G490.74
N251,3-BIS-(4-METHOXY-BENZENESULFONYL)-
5,5-DIMETHYL-HEXAHYDRO-PYRIMIDINE-
2-CARBOXYLIC ACID HYDROXYAMIDE
A,B1BQO0.72