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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00015006

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TRTFRAGMENT OF TRITON X-100A,E2I0U0.72
TRTFRAGMENT OF TRITON X-100A,B1OIZ0.72
POT(1S)-1-(PHENOXYMETHYL)PROPYL METHYLPHOSPHONOCHLORIDOATEA2NW60.79
TF52-[(2',3',4'-TRIFLUOROBIPHENYL-
2-YL)OXY]ETHANOL
A,B2OP30.75
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
BOP1-BROMO-4-METHOXYBENZENEC,F1RHQ0.81
FFP2,6-DIFLUOROPHENOLA2INX0.71
2682-phenoxyethanolA2RBR0.85
FP22-fluorophenolA3CPO0.73
4403-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}propane-
1-thiol
A3B920.71
258(2-chloroethoxy)benzeneX2RAY0.86
LJ42,6-dibromo-4-phenoxyphenolA,B3CN30.75
2612-ethoxyphenolX2RB10.79
4BR2-(4-METHYLPHENOXY)ETHYLPHOSPHINATEA1PE70.76
MSB1-METHYLOXY-4-SULFONE-BENZENEA1EUB0.73
MSB1-METHYLOXY-4-SULFONE-BENZENEA1BM60.73
EPLDIETHYL 4-METHOXYPHENYL PHOSPHATEA2R1N0.77
FPN4-FLUOROPHENOLA,B1XVD0.73
INK(RP,SP)-O-(2R)-(1-PHENOXYBUT-2-
YL)-METHYLPHOSPHONIC ACID CHLORIDE
A1HQD0.79
TON2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOLA,B1SEZ0.71