BDBM50216193 CHEMBL233609::N-(2-methoxyphenethyl)-4-(((S)-2-(methoxymethyl)pyrrolidin-1-yl)methyl)-N-(pyrrolidin-3-yl)benzamide

SMILES: COC[C@@H]1CCCN1Cc1ccc(cc1)C(=O)N(CCc1ccccc1OC)C1CCNC1

InChI Key: InChIKey=NOQHHDCNSWECFD-BBMPLOMVSA-N

Data: 1 IC50

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 1 hit for monomerid = 50216193   

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
Membrane-bound transcription factor site-1 protease (Homo sapiens (Human))	BDBM50216193 (CHEMBL233609 | N-(2-methoxyphenethyl)-4-(((S)-2-(m...) Show SMILES COC[C@@H]1CCCN1Cc1ccc(cc1)C(=O)N(CCc1ccccc1OC)C1CCNC1 |w:28.30| Show InChI InChI=1S/C27H37N3O3/c1-32-20-25-7-5-16-29(25)19-21-9-11-23(12-10-21)27(31)30(24-13-15-28-18-24)17-14-22-6-3-4-8-26(22)33-2/h3-4,6,8-12,24-25,28H,5,7,13-20H2,1-2H3/t24?,25-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development-Groton Laboratories Curated by ChEMBL					Assay Description Inhibition of human S1P expressed in CHOK1 cells				Bioorg Med Chem Lett 17: 4411-4 (2007) Article DOI: 10.1016/j.bmcl.2007.06.031 BindingDB Entry DOI: 10.7270/Q26M36JG
					More data for this Ligand-Target Pair