Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 5' and Ligand = 'BDBM50268794'   

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 (Homo sapiens (Human))	BDBM50268794 (Ac-Nle-c[Asp-His-DPhe-cis-4-guanidinyl-Pro-Trp-Lys...) Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.76,12.11,41.72,4.4,wD:57.61,25.25,39.45,(20.33,-40.8,;18.97,-40.08,;18.92,-38.54,;17.56,-37.81,;17.51,-36.27,;18.82,-35.46,;18.77,-33.92,;20.08,-33.11,;17.41,-33.19,;16.15,-35.55,;16.1,-34.01,;14.85,-36.36,;13.49,-35.64,;12.18,-36.45,;12.23,-37.99,;13.59,-38.71,;10.92,-38.8,;9.56,-38.08,;8.26,-38.89,;6.9,-38.17,;5.59,-38.98,;4.23,-38.25,;4.18,-36.71,;2.82,-35.99,;1.52,-36.8,;2.77,-34.45,;1.41,-33.72,;1.36,-32.19,;2.59,-31.24,;2.06,-29.79,;.52,-29.85,;-.55,-28.75,;-2.04,-29.13,;-2.45,-30.61,;-1.37,-31.7,;.1,-31.32,;4.08,-33.64,;4.74,-34.72,;5.06,-36.27,;5.44,-34.36,;6.06,-35.94,;7.6,-35.89,;8.02,-34.41,;6.75,-33.55,;6.7,-32.01,;5.34,-31.28,;8,-31.2,;7.95,-29.66,;6.59,-28.93,;6.55,-27.39,;5.19,-26.67,;3.88,-27.48,;3.94,-29.03,;5.29,-29.75,;9.36,-31.92,;10.67,-31.11,;10.62,-29.57,;12.03,-31.83,;13.33,-31.02,;13.29,-29.48,;14.51,-28.54,;14,-27.09,;12.46,-27.13,;12.02,-28.61,;12.08,-33.37,;13.44,-34.1,;14.74,-33.28,;8.54,-37.11,;10.04,-36.73,;10.8,-37.54,;10.65,-35.47,;2.93,-39.07,;1.57,-38.34,;2.98,-40.61,)| Show InChI InChI=1S/C50H67N15O9/c1-3-4-15-36(58-28(2)66)44(69)62-39-23-42(67)55-18-11-10-17-35(43(51)68)60-45(70)37(20-30-24-56-34-16-9-8-14-33(30)34)63-48(73)41-22-32(59-50(52)53)26-65(41)49(74)40(19-29-12-6-5-7-13-29)64-46(71)38(61-47(39)72)21-31-25-54-27-57-31/h5-9,12-14,16,24-25,27,32,35-41,56H,3-4,10-11,15,17-23,26H2,1-2H3,(H2,51,68)(H,54,57)(H,55,67)(H,58,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)(H4,52,53,59)/t32-,35-,36-,37-,38-,39-,40+,41+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	<0.100	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level				J Med Chem 52: 3627-35 (2009) Article DOI: 10.1021/jm801300c BindingDB Entry DOI: 10.7270/Q2D21ZJ5
					More data for this Ligand-Target Pair