MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: 3BT
Name: 2-{2-[3-(2-CARBAMIMIDOYLSULFANYL-ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA
SMILES: [H]N=C(N)SCCc1cccc(c1)CCS
C(=N)N

[show PDB table]

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

Neutral Molecules: 1373Ionic States: 66Tautomers: 114Drug Similarity: 2

Items found 1 - 20 of 1373

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MMs02125850 tanimoto score: 1	MMs02125849 tanimoto score: 0.97	MMs02178597 tanimoto score: 0.97	MMs02165848 tanimoto score: 0.94
MMs02166065 tanimoto score: 0.94	MMs02401674 tanimoto score: 0.94	MMs01533497 tanimoto score: 0.94	MMs02172587 tanimoto score: 0.94
MMs00754834 tanimoto score: 0.94	MMs02172586 tanimoto score: 0.94	MMs01086254 tanimoto score: 0.93	MMs01086253 tanimoto score: 0.93
MMs00016224 tanimoto score: 0.92	MMs02448311 tanimoto score: 0.91	MMs02386741 tanimoto score: 0.91	MMs02402358 tanimoto score: 0.91
MMs01709541 tanimoto score: 0.91	MMs02402359 tanimoto score: 0.91	MMs02092474 tanimoto score: 0.9	MMs02393885 tanimoto score: 0.9