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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02874208

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3HP3-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCE0.71
26CA,B2F7I0.8
4FCA1YSG0.81
1846-[HYDROXY-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTALEN-2-
YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID
A1FCX0.77
1564-[3-OXO-3-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-
YL)-PROPENYL]-BENZOIC ACID
A1FCZ0.78
1ZN(2S,3S,4E,6E,8S,9S)-3-amino-9-methoxy-
2,6,8-trimethyl-10-phenyldeca-4,6-
dienoic acid
C,F,M,N2IAE0.72
23N(2R)-2-benzyl-3-nitropropanoic acidA2RFH0.7
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.75
173BENZOYL-FORMIC ACIDA,B1SZE0.78
2NAnaphthalen-2-ylmethanolA,B,C3EE50.75
4HP4-HYDROXYPHENYLACETATEA,B,C,D2JBT0.74
4HP4-HYDROXYPHENYLACETATEA2YYJ0.74
4HP4-HYDROXYPHENYLACETATEA2YYM0.74
4HP4-HYDROXYPHENYLACETATEB1AI60.74
4HP4-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCG0.74
256PHENYL(SULFO)ACETIC ACIDA1O4Q0.76
4CB4-CARBOXYPHENYLBORONIC ACIDA,B1KDW0.74
3PL3-PHENYLPROPANALE1Y3G0.7
1LPTRANYLCYPROMINEA,B1OJB0.72
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IPW0.75
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IS70.75
2013-AMIDO-5-BIPHENYL-BENZOIC ACIDA2B0M0.71
295(2S,3S)-3-(4-fluorophenyl)-2,3-
dihydroxypropanoic acid
A,B2RJR0.74
12M(2-ETHYLPHENYL)METHANOLA,B2F620.72
4FA4-FLUOROPHENETHYL ALCOHOLA1OWZ0.74