BDBM50355798 CHEMBL1911743

SMILES: C[C@@H]1COc2ccc(cc2[C@H](C)N1C(=O)c1ccc(Cl)cc1)C#N

InChI Key: InChIKey=VZTZUKGKZZSSEM-OLZOCXBDSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50355798   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Orexin receptor type 2 (Homo sapiens (Human))	BDBM50355798 (CHEMBL1911743) Show SMILES C[C@@H]1COc2ccc(cc2[C@H](C)N1C(=O)c1ccc(Cl)cc1)C#N |r| Show InChI InChI=1S/C19H17ClN2O2/c1-12-11-24-18-8-3-14(10-21)9-17(18)13(2)22(12)19(23)15-4-6-16(20)7-5-15/h3-9,12-13H,11H2,1-2H3/t12-,13+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company Curated by ChEMBL					Assay Description Antagonist activity at human OX2R expressed in CHO cells assessed intracellular calcium mobilization by FLIPR assay				Bioorg Med Chem Lett 21: 6414-6 (2011) Article DOI: 10.1016/j.bmcl.2011.08.093 BindingDB Entry DOI: 10.7270/Q2BZ66DH
					More data for this Ligand-Target Pair