BDBM50341685 6,6'-(2,2'-(1,4-Phenylene)bis(ethane-2,1-diyl))bis(4-methylpyridin-2-amine)::CHEMBL1766631

SMILES: Cc1cc(N)nc(CCc2ccc(CCc3cc(C)cc(N)n3)cc2)c1

InChI Key: InChIKey=AYUYENSLGNCAKQ-UHFFFAOYSA-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 = 50341685   

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
Nitric-oxide synthase, brain (Rattus norvegicus (rat))	BDBM50341685 (6,6'-(2,2'-(1,4-Phenylene)bis(ethane-2,1-diyl))bis...) Show SMILES Cc1cc(N)nc(CCc2ccc(CCc3cc(C)cc(N)n3)cc2)c1 Show InChI InChI=1S/C22H26N4/c1-15-11-19(25-21(23)13-15)9-7-17-3-5-18(6-4-17)8-10-20-12-16(2)14-22(24)26-20/h3-6,11-14H,7-10H2,1-2H3,(H2,23,25)(H2,24,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	97	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwestern University Curated by ChEMBL					Assay Description Inhibition of rat recombinant nNOS expressed in Escherichia coli by UV-vis spectrometric analysis				J Med Chem 54: 2039-48 (2011) Article DOI: 10.1021/jm101071n BindingDB Entry DOI: 10.7270/Q2571CB0
					More data for this Ligand-Target Pair
Nitric Oxide Synthase, endothelial (Bos taurus (bovine))	BDBM50341685 (6,6'-(2,2'-(1,4-Phenylene)bis(ethane-2,1-diyl))bis...) Show SMILES Cc1cc(N)nc(CCc2ccc(CCc3cc(C)cc(N)n3)cc2)c1 Show InChI InChI=1S/C22H26N4/c1-15-11-19(25-21(23)13-15)9-7-17-3-5-18(6-4-17)8-10-20-12-16(2)14-22(24)26-20/h3-6,11-14H,7-10H2,1-2H3,(H2,23,25)(H2,24,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.39E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwestern University Curated by ChEMBL					Assay Description Inhibition of bovine recombinant eNOS expressed in Escherichia coli by UV-vis spectrometric analysis				J Med Chem 54: 2039-48 (2011) Article DOI: 10.1021/jm101071n BindingDB Entry DOI: 10.7270/Q2571CB0
					More data for this Ligand-Target Pair
Nitric Oxide Synthase, inducible (Mus musculus (mouse))	BDBM50341685 (6,6'-(2,2'-(1,4-Phenylene)bis(ethane-2,1-diyl))bis...) Show SMILES Cc1cc(N)nc(CCc2ccc(CCc3cc(C)cc(N)n3)cc2)c1 Show InChI InChI=1S/C22H26N4/c1-15-11-19(25-21(23)13-15)9-7-17-3-5-18(6-4-17)8-10-20-12-16(2)14-22(24)26-20/h3-6,11-14H,7-10H2,1-2H3,(H2,23,25)(H2,24,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.41E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwestern University Curated by ChEMBL					Assay Description Inhibition of mouse macrophage recombinant iNOS expressed in Escherichia coli by UV-vis spectrometric analysis				J Med Chem 54: 2039-48 (2011) Article DOI: 10.1021/jm101071n BindingDB Entry DOI: 10.7270/Q2571CB0
					More data for this Ligand-Target Pair