Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Melanocyte-stimulating hormone receptor' and Ligand = 'BDBM50141025'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50141025 (1N-(1-carbamoyl-2-hydroxypropyl)-15-[3-amino(imino...) Show SMILES C[C@@H](O)[C@H](NC(=O)[C@H]1CSSC[C@H](NC(=O)[C@H](N)Cc2ccccc2)C(=O)N[C@H](Cc2ccc(I)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]([C@@H](C)O)C(=O)N1)C(N)=O Show InChI InChI=1S/C49H64IN13O10S2/c1-25(64)39(41(52)66)62-47(72)38-24-75-74-23-37(60-42(67)32(51)19-27-9-4-3-5-10-27)46(71)58-35(20-28-14-16-30(50)17-15-28)44(69)59-36(21-29-22-56-33-12-7-6-11-31(29)33)45(70)57-34(13-8-18-55-49(53)54)43(68)63-40(26(2)65)48(73)61-38/h3-7,9-12,14-17,22,25-26,32,34-40,56,64-65H,8,13,18-21,23-24,51H2,1-2H3,(H2,52,66)(H,57,70)(H,58,71)(H,59,69)(H,60,67)(H,61,73)(H,62,72)(H,63,68)(H4,53,54,55)/t25-,26-,32-,34+,35-,36+,37+,38-,39+,40-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Inhibition of 1 nM alpha melanocortin stimulating hormone (MSH) from frog skin				J Med Chem 47: 1514-26 (2004) Article DOI: 10.1021/jm030452x BindingDB Entry DOI: 10.7270/Q2XP75PK
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