Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 5' and Ligand = 'BDBM50232414'   

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
Melanocortin receptor 5 (Mus musculus (Mouse))	BDBM50232414 (CHEMBL4069451) Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C58H72N16O10/c1-33-49(76)72-45(26-35-15-6-3-7-16-35)56(83)74-24-12-21-47(74)57(84)73-23-11-20-46(73)55(82)71-43(28-37-31-62-32-65-37)54(81)68-41(25-34-13-4-2-5-14-34)52(79)67-40(19-10-22-63-58(60)61)50(77)69-42(27-36-30-64-39-18-9-8-17-38(36)39)53(80)70-44(29-48(59)75)51(78)66-33/h2-9,13-18,30-33,40-47,64H,10-12,19-29H2,1H3,(H2,59,75)(H,62,65)(H,66,78)(H,67,79)(H,68,81)(H,69,77)(H,70,80)(H,71,82)(H,72,76)(H4,60,61,63)/t33-,40-,41+,42-,43-,44-,45-,46-,47+/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.450	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Agonist activity at mouse MC5R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...				J Med Chem 60: 805-813 (2017) Article DOI: 10.1021/acs.jmedchem.6b01707 BindingDB Entry DOI: 10.7270/Q2R213MT
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