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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00755344

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4403-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}propane-
1-thiol
A3B920.83
EPLDIETHYL 4-METHOXYPHENYL PHOSPHATEA2R1N0.79
IPHPHENOLA,B2OLD0.7
IPHPHENOLA,B,C,D2PZV0.7
IPHPHENOLA1LI20.7
IPHPHENOLA2J9N0.7
IPHPHENOLA,B,C,D2OMB0.7
IPHPHENOLA1JHX0.7
IPHPHENOLA,B,C,D2VE70.7
IPHPHENOLB,D,E,G,H,J,L1AI00.7
IPHPHENOLA,B,C,D1FOH0.7
IPHPHENOLA1V030.7
IPHPHENOLA,C,E,G,I,K5AIY0.7
IPHPHENOLB,D,F,H,J,L1AIY0.7
IPHPHENOLA,B1XU50.7
IPHPHENOLA,B,C,D,E,G,
I,K
1W8P0.7
IPHPHENOLA,C,E,G,I,K4AIY0.7
IPHPHENOLA,B,C,D,E,F,
G,H
1XDA0.7
IPHPHENOLA2AS30.7
IPHPHENOLA,B,C,D1ZEG0.7
IPHPHENOLA,B,C,D1PN00.7
IPHPHENOLA,B,C,D1XW70.7
IPHPHENOLA,C,E,G,I,K,M1QIY0.7
IPHPHENOLA,B,C,D1Q4V0.7
IPHPHENOLB1AI70.7
IPHPHENOLA1FJW0.7
IPHPHENOLB,C,D1RWE0.7
IPHPHENOLA,B,C,D,E,G,
H,I,K
1ZNJ0.7
IPHPHENOLB,C,D3GKY0.7
IPHPHENOLA1JHY0.7
IPHPHENOLA,C,E,G,I,K3AIY0.7
IPHPHENOLA,B2OMN0.7
IPHPHENOLA,C,E,G,I,K2AIY0.7
IPHPHENOLA,B,D1MPJ0.7
IPHPHENOLA,B,C,D,F,G,
H,J
1WAV0.7
IPHPHENOLB,C,D1LPH0.7
POT(1S)-1-(PHENOXYMETHYL)PROPYL METHYLPHOSPHONOCHLORIDOATEA2NW60.81
TRTFRAGMENT OF TRITON X-100A,E2I0U0.74
TRTFRAGMENT OF TRITON X-100A,B1OIZ0.74
TON2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOLA,B1SEZ0.72
2682-phenoxyethanolA2RBR0.85
PSYphenyl ethenesulfonateA3BM80.78
PSYphenyl ethenesulfonateA3BLT0.78
MSB1-METHYLOXY-4-SULFONE-BENZENEA1EUB0.79
MSB1-METHYLOXY-4-SULFONE-BENZENEA1BM60.79
TF52-[(2',3',4'-TRIFLUOROBIPHENYL-
2-YL)OXY]ETHANOL
A,B2OP30.7
258(2-chloroethoxy)benzeneX2RAY0.86
2612-ethoxyphenolX2RB10.79
HTS2-MERCAPTOPHENOLA2OSM0.71
505(2R)-1-(2,6-dimethylphenoxy)propan-
2-amine
A2VIN0.71
B65(1R)-4-(3-phenoxyphenyl)-1-phosphonobutane-
1-sulfonic acid
A2ZCQ0.71
4BR2-(4-METHYLPHENOXY)ETHYLPHOSPHINATEA1PE70.76
283(3S)-1-{[4-(BUT-2-YN-1-YLOXY)PHENYL]SULFONYL}PYRROLIDINE-
3-THIOL
A2OI00.75
INK(RP,SP)-O-(2R)-(1-PHENOXYBUT-2-
YL)-METHYLPHOSPHONIC ACID CHLORIDE
A1HQD0.81
BOP1-BROMO-4-METHOXYBENZENEC,F1RHQ0.75