MMsINC Database Search
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Ligand PDB



ligand: TR1
Name: 2-(2-{2-[(BIPHENYL-4-YLMETHYL)-AMINO]-3-MERCAPTO-PENTANOYLAMINO}-ACETYLAMINO)-3-METHYL-BUTYRIC ACID METHYL ESTER
SMILES: C
C(C)C(C(=O)OC)NC(=O)CNC(=O)C(CS)NCc1ccc(cc1)c2ccccc2
[show PDB table]


MMsINC molecules which have a Tanimoto coefficient superior or equal to 0.70

Neutral Molecules: 37270Ionic States: 12251Tautomers: 1089Drug Similarity: 88 Items found 1 - 20 of 37270 



of 1864    Go to Page   



MMs03082018
tanimoto score: 1

MMs03082017
tanimoto score: 1

MMs03082015
tanimoto score: 1

MMs03082016
tanimoto score: 1

MMs03439832
tanimoto score: 0.87

MMs03439776
tanimoto score: 0.87

MMs03929826
tanimoto score: 0.86

MMs03929825
tanimoto score: 0.86

MMs03929827
tanimoto score: 0.86

MMs03761737
tanimoto score: 0.86

MMs02438492
tanimoto score: 0.86

MMs02438491
tanimoto score: 0.86

MMs02438493
tanimoto score: 0.86

MMs02438494
tanimoto score: 0.86

MMs00453217
tanimoto score: 0.86

MMs00475348
tanimoto score: 0.86

MMs02418601
tanimoto score: 0.86

MMs01374021
tanimoto score: 0.86

MMs03929828
tanimoto score: 0.86

MMs02443584
tanimoto score: 0.85


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