BDBM50514107 CHEMBL4535316

SMILES: OC(=O)\C=C\C(O)=O.CCNC1CN(C1)c1ccnc(N)n1

InChI Key: InChIKey=ZLJSKUVIFFOUHF-UHFFFAOYSA-N

Data: 1 KI  1 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 2 hits for monomerid = 50514107   

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 H3 receptor (Homo sapiens (Human))	BDBM50514107 (CHEMBL4535316) Show SMILES OC(=O)\C=C\C(O)=O.CCNC1CN(C1)c1ccnc(N)n1 Show InChI InChI=1S/C9H15N5/c1-2-11-7-5-14(6-7)8-3-4-12-9(10)13-8/h3-4,7,11H,2,5-6H2,1H3,(H2,10,12,13)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]NAMH from human H3R expressed in HEK293T cells incubated for 2 hrs by microbeta scintillation counting analysis				J Med Chem 62: 10848-10866 (2019) Article DOI: 10.1021/acs.jmedchem.9b01462
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50514107 (CHEMBL4535316) Show SMILES OC(=O)\C=C\C(O)=O.CCNC1CN(C1)c1ccnc(N)n1 Show InChI InChI=1S/C9H15N5/c1-2-11-7-5-14(6-7)8-3-4-12-9(10)13-8/h3-4,7,11H,2,5-6H2,1H3,(H2,10,12,13)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	0.631	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Agonist activity at human H3R expressed on HEK293T cells assessed as inhibition of forskolin-induced CRE-driven luciferase activity co-incubated with...				J Med Chem 62: 10848-10866 (2019) Article DOI: 10.1021/acs.jmedchem.9b01462
					More data for this Ligand-Target Pair