Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 446.4 BDBM50544800

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
Probable G-protein coupled receptor 142 (Homo sapiens (Human))	BDBM50544800 (CHEMBL4647745) Show SMILES CN([C@@H]1CCC[C@@H](C1)c1nnc([nH]1)-c1c(C)ncn1C)C(=O)c1cccc(c1)C(F)(F)F |r| Show InChI InChI=1S/C22H25F3N6O/c1-13-18(30(2)12-26-13)20-27-19(28-29-20)14-6-5-9-17(11-14)31(3)21(32)15-7-4-8-16(10-15)22(23,24)25/h4,7-8,10,12,14,17H,5-6,9,11H2,1-3H3,(H,27,28,29)/t14-,17+/m0/s1	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	11	n/a	n/a	n/a	n/a
Lilly China Research and Development Center (LCRDC) Curated by ChEMBL					Assay Description Agonist activity at human GPR142 receptor expressed in HEK293 cells assessed as accumulation of inositol phosphate incubated for 1 hr followed by IP1...				Bioorg Med Chem Lett 30: (2020) Article DOI: 10.1016/j.bmcl.2019.126857 BindingDB Entry DOI: 10.7270/Q2154MMP
					More data for this Ligand-Target Pair