Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histamine H2 receptor' and Ligand = 'BDBM50440991'   

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
Histamine H2 receptor (Homo sapiens (Human))	BDBM50440991 (CHEMBL2432048) Show SMILES C(Cc1ccccc1)N[C@@H]1C2C3CC4C5CC(C2C35)C14 |r,THB:10:17:15:19.13,9:19:17.18:15,11:18:15:19.13,12:13:17.18:15| Show InChI InChI=1S/C19H23N/c1-2-4-10(5-3-1)6-7-20-19-16-12-9-13-15-11(12)8-14(16)17(15)18(13)19/h1-5,11-20H,6-9H2/t11?,12?,13?,14?,15?,16?,17?,18?,19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of histamine H2 receptor (unknown origin) by PDSP assay				Bioorg Med Chem 21: 6038-52 (2013) Article DOI: 10.1016/j.bmc.2013.07.045 BindingDB Entry DOI: 10.7270/Q20P11GK
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