null

SMILES: CC(=O)c1ccc(OCCCN2CC[C@@H](C2)NC(=O)[C@@H](N)CO)cc1

InChI Key: InChIKey=IBVAFMSEJOGFLC-RDJZCZTQSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50119713   

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 (Rattus norvegicus (rat))	BDBM50119713 ((S)-N-{(S)-1-[3-(4-Acetyl-phenoxy)-propyl]-pyrroli...) Show SMILES CC(=O)c1ccc(OCCCN2CC[C@@H](C2)NC(=O)[C@@H](N)CO)cc1 Show InChI InChI=1S/C18H27N3O4/c1-13(23)14-3-5-16(6-4-14)25-10-2-8-21-9-7-15(11-21)20-18(24)17(19)12-22/h3-6,15,17,22H,2,7-12,19H2,1H3,(H,20,24)/t15-,17-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	151	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Binding affinity against rat histamine H3 receptor				Bioorg Med Chem Lett 12: 3055-8 (2002) BindingDB Entry DOI: 10.7270/Q2B56J3P
					More data for this Ligand-Target Pair
Histamine H2 receptor (Homo sapiens (Human))	BDBM50119713 ((S)-N-{(S)-1-[3-(4-Acetyl-phenoxy)-propyl]-pyrroli...) Show SMILES CC(=O)c1ccc(OCCCN2CC[C@@H](C2)NC(=O)[C@@H](N)CO)cc1 Show InChI InChI=1S/C18H27N3O4/c1-13(23)14-3-5-16(6-4-14)25-10-2-8-21-9-7-15(11-21)20-18(24)17(19)12-22/h3-6,15,17,22H,2,7-12,19H2,1H3,(H,20,24)/t15-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	2.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Binding affinity to the human Histamine H2 receptor				Bioorg Med Chem Lett 12: 3055-8 (2002) BindingDB Entry DOI: 10.7270/Q2B56J3P
					More data for this Ligand-Target Pair
Histamine H1 receptor (Homo sapiens (Human))	BDBM50119713 ((S)-N-{(S)-1-[3-(4-Acetyl-phenoxy)-propyl]-pyrroli...) Show SMILES CC(=O)c1ccc(OCCCN2CC[C@@H](C2)NC(=O)[C@@H](N)CO)cc1 Show InChI InChI=1S/C18H27N3O4/c1-13(23)14-3-5-16(6-4-14)25-10-2-8-21-9-7-15(11-21)20-18(24)17(19)12-22/h3-6,15,17,22H,2,7-12,19H2,1H3,(H,20,24)/t15-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	4.30E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Binding affinity to the human Histamine H1 receptor				Bioorg Med Chem Lett 12: 3055-8 (2002) BindingDB Entry DOI: 10.7270/Q2B56J3P
					More data for this Ligand-Target Pair