BDBM50001753 CHEMBL3238446

SMILES: C[C@H](NCc1ccc(OCCCN2CCCCC2)cc1)C(N)=O

InChI Key: InChIKey=WMVDPHRVWOFAIP-HNNXBMFYSA-N

Data: 3 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 3 hits for monomerid = 50001753   

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))	BDBM50001753 (CHEMBL3238446) Show SMILES C[C@H](NCc1ccc(OCCCN2CCCCC2)cc1)C(N)=O |r| Show InChI InChI=1S/C18H29N3O2/c1-15(18(19)22)20-14-16-6-8-17(9-7-16)23-13-5-12-21-10-3-2-4-11-21/h6-9,15,20H,2-5,10-14H2,1H3,(H2,19,22)/t15-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	43	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
United Arab Emirates University Curated by ChEMBL					Assay Description Displacement of [3H]N-alpha-methylhistamine from human H3 receptor expressed in HEK-293 cell membrane after 90 mins by liquid scintillation counting ...				Eur J Med Chem 77: 269-79 (2014) Article DOI: 10.1016/j.ejmech.2014.03.014 BindingDB Entry DOI: 10.7270/Q29K4CR6
					More data for this Ligand-Target Pair
Histamine H1 receptor (Homo sapiens (Human))	BDBM50001753 (CHEMBL3238446) Show SMILES C[C@H](NCc1ccc(OCCCN2CCCCC2)cc1)C(N)=O |r| Show InChI InChI=1S/C18H29N3O2/c1-15(18(19)22)20-14-16-6-8-17(9-7-16)23-13-5-12-21-10-3-2-4-11-21/h6-9,15,20H,2-5,10-14H2,1H3,(H2,19,22)/t15-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	3.16E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
United Arab Emirates University Curated by ChEMBL					Assay Description Displacement of [3H]pyrilamine from human H1 receptor expressed in CHO cell membrane after 120 mins by liquid scintillation counting analysis				Eur J Med Chem 77: 269-79 (2014) Article DOI: 10.1016/j.ejmech.2014.03.014 BindingDB Entry DOI: 10.7270/Q29K4CR6
					More data for this Ligand-Target Pair
Histamine H4 receptor (Homo sapiens (Human))	BDBM50001753 (CHEMBL3238446) Show SMILES C[C@H](NCc1ccc(OCCCN2CCCCC2)cc1)C(N)=O |r| Show InChI InChI=1S/C18H29N3O2/c1-15(18(19)22)20-14-16-6-8-17(9-7-16)23-13-5-12-21-10-3-2-4-11-21/h6-9,15,20H,2-5,10-14H2,1H3,(H2,19,22)/t15-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	3.31E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
United Arab Emirates University Curated by ChEMBL					Assay Description Displacement of [3H]histamine from human H4 receptor expressed in Sf9 cell membrane co-transfected with Galphai2 and Gbeta1gamma2 after 60 mins by li...				Eur J Med Chem 77: 269-79 (2014) Article DOI: 10.1016/j.ejmech.2014.03.014 BindingDB Entry DOI: 10.7270/Q29K4CR6
					More data for this Ligand-Target Pair