MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: CNE
Name: (3S)-5-[(2-CHLORO-6-FLUOROBENZYL)SULFANYL]-3-{[N-({2-ETHOXY-5-[(1E)-3-METHOXY-3-OXOPROP-1-ENYL]PHENYL}ACETYL)-
D-VALYL]AMINO}-4-OXOPENTANOIC ACID
SMILES: CCOc1ccc(cc1CC(=O)NC(C(C)C)C(=O)NC(CC(=O)O)C(=O)CSCc2c(cc
cc2Cl)F)C=CC(=O)OC

[show PDB table]

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

Neutral Molecules: 9576Ionic States: 5492Tautomers: 1967Drug Similarity: 13

Items found 161 - 180 of 9576

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MMs00322186 tanimoto score: 0.77	MMs00322187 tanimoto score: 0.77	MMs00456497 tanimoto score: 0.77	MMs00561160 tanimoto score: 0.77
MMs01160668 tanimoto score: 0.77	MMs01646052 tanimoto score: 0.77	MMs00538352 tanimoto score: 0.76	MMs00538354 tanimoto score: 0.76
MMs00879564 tanimoto score: 0.76	MMs00879562 tanimoto score: 0.76	MMs00879536 tanimoto score: 0.76	MMs00559513 tanimoto score: 0.76
MMs00879538 tanimoto score: 0.76	MMs00879532 tanimoto score: 0.76	MMs00559515 tanimoto score: 0.76	MMs00879534 tanimoto score: 0.76
MMs00879558 tanimoto score: 0.76	MMs00559152 tanimoto score: 0.76	MMs00287291 tanimoto score: 0.76	MMs00879522 tanimoto score: 0.76

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