Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 516.6 BDBM50253661

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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 3 (Homo sapiens (Human))	BDBM50253661 ((S)-2-((S)-3-allyl-4-((R)-2-amino-3-(4-fluoropheny...) Show SMILES CNC(=O)[C@H](Cc1ccc2ccccc2c1)N1CCN([C@@H](CC=C)C1=O)C(=O)[C@H](N)Cc1ccc(F)cc1 |r| Show InChI InChI=1S/C30H33FN4O3/c1-3-6-26-30(38)35(16-15-34(26)29(37)25(32)18-20-10-13-24(31)14-11-20)27(28(36)33-2)19-21-9-12-22-7-4-5-8-23(22)17-21/h3-5,7-14,17,25-27H,1,6,15-16,18-19,32H2,2H3,(H,33,36)/t25-,26+,27+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	148	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Agonist activity at human MC3R expressed in HEK293 cells assessed as effect on CRE-driven luminescence by luciferase reporter gene assay				J Med Chem 51: 6055-66 (2008) Article DOI: 10.1021/jm800525p BindingDB Entry DOI: 10.7270/Q2DV1JQC
					More data for this Ligand-Target Pair