Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Melanocyte-stimulating hormone receptor' and Ligand = 'BDBM50141039'   

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))	BDBM50141039 (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(O)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/C49H65N13O11S2/c1-25(63)39(41(51)66)61-47(72)38-24-75-74-23-37(59-42(67)32(50)19-27-9-4-3-5-10-27)46(71)57-35(20-28-14-16-30(65)17-15-28)44(69)58-36(21-29-22-55-33-12-7-6-11-31(29)33)45(70)56-34(13-8-18-54-49(52)53)43(68)62-40(26(2)64)48(73)60-38/h3-7,9-12,14-17,22,25-26,32,34-40,55,63-65H,8,13,18-21,23-24,50H2,1-2H3,(H2,51,66)(H,56,70)(H,57,71)(H,58,69)(H,59,67)(H,60,73)(H,61,72)(H,62,68)(H4,52,53,54)/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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