MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: BUK
Name: N~2~-({[(1R)-1-(4-BROMOPHENYL)ETHYL]AMINO}CARBONYL)ASPARAGINYL-N~1~-{4-{[AMINO(IMINO)METHYL]AMINO}-
1-[2,3-DIHYDRO-1,3-THIAZOL-2-YL(HYDROXY)METHYL]BUTYL}VALINAMIDE
SMILES: [H]N=C(N)NCCCC(C(C1NC=CS1)O)
NC(=O)C(C(C)C)NC(=O)C(CC(=O)N)NC(=O)NC(C)c2ccc(cc2)Br

[show PDB table]

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

Neutral Molecules: 38Ionic States: 14Tautomers: 9Drug Similarity: 0

Items found 1 - 20 of 38

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MMs00558370 tanimoto score: 0.74	MMs01574611 tanimoto score: 0.74	MMs01574609 tanimoto score: 0.74	MMs03922801 tanimoto score: 0.73
MMs00722675 tanimoto score: 0.73	MMs00722676 tanimoto score: 0.73	MMs02418973 tanimoto score: 0.73	MMs02418977 tanimoto score: 0.73
MMs02418980 tanimoto score: 0.73	MMs02418983 tanimoto score: 0.73	MMs03922800 tanimoto score: 0.73	MMs02507807 tanimoto score: 0.72
MMs00558362 tanimoto score: 0.72	MMs02507805 tanimoto score: 0.72	MMs00670937 tanimoto score: 0.72	MMs00670938 tanimoto score: 0.72
MMs02507806 tanimoto score: 0.72	MMs02507804 tanimoto score: 0.72	MMs02419077 tanimoto score: 0.71	MMs02419079 tanimoto score: 0.71

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