BDBM50170116 CHEMBL3805813

SMILES: NC[C@H]1CC[C@@H](C1)c1c[nH]cn1

InChI Key: InChIKey=OCAVWRASUZEXJS-YUMQZZPRSA-N

Data: 1 KI  2 EC50

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 3 hits for monomerid = 50170116   

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 H1 receptor (Homo sapiens (Human))	BDBM50170116 (CHEMBL3805813) Show SMILES NC[C@H]1CC[C@@H](C1)c1c[nH]cn1 |r| Show InChI InChI=1S/C9H15N3/c10-4-7-1-2-8(3-7)9-5-11-6-12-9/h5-8H,1-4,10H2,(H,11,12)/t7-,8-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Displacement of [3H]mepyramine from human histamine H1 receptor expressed in sf9 cell membrane co-expressing RGS4 incubated for 60 mins by liquid sci...				J Med Chem 59: 3452-70 (2016) BindingDB Entry DOI: 10.7270/Q23T9K42
					More data for this Ligand-Target Pair
Histamine H4 receptor (Homo sapiens (Human))	BDBM50170116 (CHEMBL3805813) Show SMILES NC[C@H]1CC[C@@H](C1)c1c[nH]cn1 |r| Show InChI InChI=1S/C9H15N3/c10-4-7-1-2-8(3-7)9-5-11-6-12-9/h5-8H,1-4,10H2,(H,11,12)/t7-,8-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.71E+3	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Agonist activity at human histamine H4 receptor expressed in sf9 cell membrane co-expressing mammalian Galphai2 and Gbeta1gamma2 incubated for 90 min...				J Med Chem 59: 3452-70 (2016) BindingDB Entry DOI: 10.7270/Q23T9K42
					More data for this Ligand-Target Pair
Histamine H2 receptor (Homo sapiens (Human))	BDBM50170116 (CHEMBL3805813) Show SMILES NC[C@H]1CC[C@@H](C1)c1c[nH]cn1 |r| Show InChI InChI=1S/C9H15N3/c10-4-7-1-2-8(3-7)9-5-11-6-12-9/h5-8H,1-4,10H2,(H,11,12)/t7-,8-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Agonist activity at human histamine H2 receptor expressed in sf9 cell membrane co-expressing Gsalphas incubated for 90 mins by [35S]GTPgammaS binding...				J Med Chem 59: 3452-70 (2016) BindingDB Entry DOI: 10.7270/Q23T9K42
					More data for this Ligand-Target Pair