MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: S1S
Name: 2-(4-((9S,10S,14S,Z)-18-(2-AMINO-2-OXOETHYL)-9-(CARBOXYMETHYL)-14-(NAPHTHALEN-1-YLMETHYL)-8,17,20-
TRIOXO-7,16,19-TRIAZASPIRO[5.14]ICOS-11-EN-10-YL)PHENYL)MALONIC ACID
SMILES: c1ccc2c(c1)cccc2CC3CC=C
C(C(C(=O)NC4(CCCCC4)C(=O)NC(C(=O)NC3)CC(=O)N)CC(=O)O)c5ccc(cc5)C(C(=O)O)C(=O)O

[show PDB table]

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

Neutral Molecules: 1830Ionic States: 578Tautomers: 12Drug Similarity: 4

Items found 1 - 20 of 1830

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MMs03927027 tanimoto score: 0.81	MMs02675300 tanimoto score: 0.81	MMs03927026 tanimoto score: 0.81	MMs03927028 tanimoto score: 0.81
MMs03927025 tanimoto score: 0.81	MMs02244253 tanimoto score: 0.79	MMs02244251 tanimoto score: 0.79	MMs02244247 tanimoto score: 0.79
MMs02244249 tanimoto score: 0.79	MMs00016745 tanimoto score: 0.78	MMs00017977 tanimoto score: 0.78	MMs00881769 tanimoto score: 0.78
MMs00881773 tanimoto score: 0.78	MMs00881771 tanimoto score: 0.78	MMs00469608 tanimoto score: 0.78	MMs00469606 tanimoto score: 0.78
MMs02616293 tanimoto score: 0.78	MMs00469602 tanimoto score: 0.78	MMs00016747 tanimoto score: 0.78	MMs00469604 tanimoto score: 0.78

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