BDBM50489108 CHEMBL2296821

SMILES: CCCc1nc(nc2Sc3ccccc3Nc12)N1CCC(C)CC1

InChI Key: InChIKey=BSRCTCMREBPJCR-UHFFFAOYSA-N

Data: 1 KI  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 2 hits for monomerid = 50489108   

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
Seed lipoxygenase-1 (Glycine max (soybean))	BDBM50489108 (CHEMBL2296821) Show SMILES CCCc1nc(nc2Sc3ccccc3Nc12)N1CCC(C)CC1 Show InChI InChI=1S/C19H24N4S/c1-3-6-15-17-18(24-16-8-5-4-7-14(16)20-17)22-19(21-15)23-11-9-13(2)10-12-23/h4-5,7-8,13,20H,3,6,9-12H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article	486	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of Glycine max (soybean) 15-lipoxygenase activity assessed as decrease in peroxide formation using linoleic acid as substrate preincubated...				Citation and Details Article DOI: 10.1007/s00044-013-0506-7 BindingDB Entry DOI: 10.7270/Q2M90CKG
					More data for this Ligand-Target Pair
Seed lipoxygenase-1 (Glycine max (soybean))	BDBM50489108 (CHEMBL2296821) Show SMILES CCCc1nc(nc2Sc3ccccc3Nc12)N1CCC(C)CC1 Show InChI InChI=1S/C19H24N4S/c1-3-6-15-17-18(24-16-8-5-4-7-14(16)20-17)22-19(21-15)23-11-9-13(2)10-12-23/h4-5,7-8,13,20H,3,6,9-12H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article	n/a	n/a	8.63E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Competitive inhibition of Glycine max (soybean) 15-lipoxygenase activity using linoleic acid as substrate by Lineweaver-burk plot analysis				Citation and Details Article DOI: 10.1007/s00044-013-0506-7 BindingDB Entry DOI: 10.7270/Q2M90CKG
					More data for this Ligand-Target Pair