BDBM55413 (8E)-2-amino-6-(phenylmethyl)-4-(3-pyridinyl)-8-(3-pyridinylmethylidene)-5,7-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile::(8E)-2-amino-6-benzyl-4-(3-pyridyl)-8-(3-pyridylmethylene)-5,7-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile::(8E)-2-amino-6-benzyl-4-pyridin-3-yl-8-(pyridin-3-ylmethylidene)-5,7-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile::(8E)-2-azanyl-6-(phenylmethyl)-4-pyridin-3-yl-8-(pyridin-3-ylmethylidene)-5,7-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile::MLS000519445::SMR000129864::cid_6309183

SMILES: N=C1OC2=C(CN(Cc3ccccc3)CC2=Cc2cccnc2)C(C1C#N)c1cccnc1

InChI Key: InChIKey=AHXRJSJXWPDORT-UHFFFAOYSA-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 = 55413   

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
neutrophil cytosolic factor 1 (Homo sapiens (Human))	BDBM55413 ((8E)-2-amino-6-(phenylmethyl)-4-(3-pyridinyl)-8-(3...) Show SMILES N=C1OC2=C(CN(Cc3ccccc3)CC2=Cc2cccnc2)C(C1C#N)c1cccnc1 |w:16.18,t:3| Show InChI InChI=1S/C27H23N5O/c28-13-23-25(21-9-5-11-31-15-21)24-18-32(16-19-6-2-1-3-7-19)17-22(26(24)33-27(23)29)12-20-8-4-10-30-14-20/h1-12,14-15,23,25,29H,16-18H2	PDB MMDB Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	3.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay					Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Susan Smith, Emory Univers...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2M90723
					More data for this Ligand-Target Pair