BDBM50197900 CHEMBL223336::N-(1-(4-fluorobenzyl)pyrrolidin-3-yl)isoquinolin-5-amine::N-[1-(4-fluorobenzyl)-3-pyrrolidyl]-N-(5-isoquinolyl)amine

SMILES: Fc1ccc(CN2CCC(C2)Nc2cccc3cnccc23)cc1

InChI Key: InChIKey=WAWIIKAKESUSCT-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50197900   

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
C-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50197900 (CHEMBL223336 | N-(1-(4-fluorobenzyl)pyrrolidin-3-y...) Show SMILES Fc1ccc(CN2CCC(C2)Nc2cccc3cnccc23)cc1 Show InChI InChI=1S/C20H20FN3/c21-17-6-4-15(5-7-17)13-24-11-9-18(14-24)23-20-3-1-2-16-12-22-10-8-19(16)20/h1-8,10,12,18,23H,9,11,13-14H2	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kirin Brewery Co. Ltd. Curated by ChEMBL					Assay Description Inhibition of MCP1-induced chemotaxis in U937 cells overexpressing CCR2				Bioorg Med Chem 15: 1022-33 (2006) Article DOI: 10.1016/j.bmc.2006.10.028 BindingDB Entry DOI: 10.7270/Q2XS5V1M
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2/Rho-kinase (ROCK I) (Homo sapiens (Human))	BDBM50197900 (CHEMBL223336 | N-(1-(4-fluorobenzyl)pyrrolidin-3-y...) Show SMILES Fc1ccc(CN2CCC(C2)Nc2cccc3cnccc23)cc1 Show InChI InChI=1S/C20H20FN3/c21-17-6-4-15(5-7-17)13-24-11-9-18(14-24)23-20-3-1-2-16-12-22-10-8-19(16)20/h1-8,10,12,18,23H,9,11,13-14H2	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	95	n/a	n/a	n/a	n/a	n/a	n/a
Kirin Brewery Co. Ltd. Curated by ChEMBL					Assay Description Inhibition of Rho kinase				Bioorg Med Chem 15: 1022-33 (2006) Article DOI: 10.1016/j.bmc.2006.10.028 BindingDB Entry DOI: 10.7270/Q2XS5V1M
					More data for this Ligand-Target Pair