Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 4' and Ligand = 'BDBM50174876'   

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 4 (Homo sapiens (Human))	BDBM50174876 (CHEMBL383143 | X1-Apc-DPhe-Arg-Trp-Z3-NH2) Show SMILES CCCC(=O)N[C@@]1(CC[C@@H](CC1)c1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(N)=O |wU:32.34,9.12,21.22,6.5,57.62,wD:6.19,43.45,(-6.2,-41.29,;-4.87,-40.52,;-3.54,-41.29,;-2.21,-40.52,;-2.21,-38.98,;-.87,-41.29,;.48,-40.52,;1.81,-39.76,;1.81,-38.23,;.48,-37.45,;-.86,-38.21,;-.86,-39.76,;.49,-35.92,;1.82,-35.15,;1.83,-33.63,;.5,-32.85,;-.84,-33.62,;-.84,-35.15,;1.8,-41.29,;1.8,-42.83,;3.14,-40.52,;4.48,-41.29,;4.48,-42.83,;5.81,-43.61,;5.8,-45.15,;7.14,-45.92,;8.48,-45.15,;8.47,-43.6,;7.13,-42.84,;5.81,-40.52,;5.81,-38.98,;7.15,-41.29,;8.48,-40.52,;8.48,-38.98,;9.82,-38.2,;9.82,-36.66,;11.16,-35.89,;11.16,-34.35,;12.5,-33.57,;9.82,-33.57,;9.82,-41.29,;9.82,-42.83,;11.16,-40.52,;12.5,-41.29,;12.5,-42.83,;13.84,-43.61,;15.18,-42.82,;16.29,-44.12,;15.51,-45.46,;15.98,-46.92,;14.96,-48.06,;13.44,-47.75,;12.97,-46.28,;14.01,-45.13,;13.84,-40.52,;13.84,-38.98,;15.18,-41.29,;16.5,-40.52,;16.5,-38.98,;17.84,-41.28,;19.17,-40.51,;17.83,-42.82,)| Show InChI InChI=1S/C46H60N10O6/c1-3-13-39(57)56-46(23-21-32(22-24-46)31-16-8-5-9-17-31)44(62)55-37(26-30-14-6-4-7-15-30)43(61)53-36(20-12-25-50-45(48)49)41(59)54-38(42(60)52-29(2)40(47)58)27-33-28-51-35-19-11-10-18-34(33)35/h4-11,14-19,28-29,32,36-38,51H,3,12-13,20-27H2,1-2H3,(H2,47,58)(H,52,60)(H,53,61)(H,54,59)(H,55,62)(H,56,57)(H4,48,49,50)/t29-,32-,36-,37+,38-,46+/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	3	n/a	n/a	n/a	n/a
Roche Research Center Curated by ChEMBL					Assay Description Agonist activity in HEK293 cells transfected with human MC4R by cAMP accumulation				Bioorg Med Chem Lett 15: 5504-8 (2005) Article DOI: 10.1016/j.bmcl.2005.08.083 BindingDB Entry DOI: 10.7270/Q2MC8ZK7
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