BDBM50440989 CHEMBL2429890

SMILES: C(N[C@@H]1C2C3CC4C5CC(C2C35)C14)c1ccc2OCOc2c1

InChI Key: InChIKey=VGYQUDBPYFLBLJ-PTCVETCVSA-N

Data: 2 KI

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 2 hits for monomerid = 50440989   

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
Histamine H2 Receptor (Homo sapiens (Human))	BDBM50440989 (CHEMBL2429890) Show SMILES C(N[C@@H]1C2C3CC4C5CC(C2C35)C14)c1ccc2OCOc2c1 |r,THB:3:10:8:12.6,2:12:10.11:8,4:11:8:12.6,5:6:10.11:8| Show InChI InChI=1S/C19H21NO2/c1-2-13-14(22-7-21-13)3-8(1)6-20-19-16-10-5-11-15-9(10)4-12(16)17(15)18(11)19/h1-3,9-12,15-20H,4-7H2/t9?,10?,11?,12?,15?,16?,17?,18?,19-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.16E+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
					More data for this Ligand-Target Pair
Histamine H1 receptor (Homo sapiens (Human))	BDBM50440989 (CHEMBL2429890) Show SMILES C(N[C@@H]1C2C3CC4C5CC(C2C35)C14)c1ccc2OCOc2c1 |r,THB:3:10:8:12.6,2:12:10.11:8,4:11:8:12.6,5:6:10.11:8| Show InChI InChI=1S/C19H21NO2/c1-2-13-14(22-7-21-13)3-8(1)6-20-19-16-10-5-11-15-9(10)4-12(16)17(15)18(11)19/h1-3,9-12,15-20H,4-7H2/t9?,10?,11?,12?,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	4.18E+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 H1 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
					More data for this Ligand-Target Pair