BDBM167159 US9073876, 241::US9732093, Compound 241

SMILES: Nc1cnc(cn1)-c1ccc(C2CCC2)c(Oc2nccc(n2)N2CCC3(CC2)OCCCO3)c1F

InChI Key: InChIKey=KVRGRKXOPKLIQV-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 = 167159   

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
5-lipoxygenase/FLAP (Homo sapiens (Human))	BDBM167159 (US9073876, 241 | US9732093, Compound 241) Show SMILES Nc1cnc(cn1)-c1ccc(C2CCC2)c(Oc2nccc(n2)N2CCC3(CC2)OCCCO3)c1F Show InChI InChI=1S/C26H29FN6O3/c27-23-19(20-15-31-21(28)16-30-20)6-5-18(17-3-1-4-17)24(23)36-25-29-10-7-22(32-25)33-11-8-26(9-12-33)34-13-2-14-35-26/h5-7,10,15-17H,1-4,8-9,11-14H2,(H2,28,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
JANSSEN PHARMACEUTICA NV US Patent					Assay Description The assay below is used to test the modulatory activity of compounds against FLAP. Human and mouse FLAP-encoding DNA was amplified by polymerase chai...				US Patent US9073876 (2015) BindingDB Entry DOI: 10.7270/Q28S4NPC
					More data for this Ligand-Target Pair
Flap endonuclease 1 (Homo sapiens (Human))	BDBM167159 (US9073876, 241 | US9732093, Compound 241) Show SMILES Nc1cnc(cn1)-c1ccc(C2CCC2)c(Oc2nccc(n2)N2CCC3(CC2)OCCCO3)c1F Show InChI InChI=1S/C26H29FN6O3/c27-23-19(20-15-31-21(28)16-30-20)6-5-18(17-3-1-4-17)24(23)36-25-29-10-7-22(32-25)33-11-8-26(9-12-33)34-13-2-14-35-26/h5-7,10,15-17H,1-4,8-9,11-14H2,(H2,28,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
JANSSEN PHARMACEUTICA NV US Patent					Assay Description The assay below is used to test the modulatory activity of compounds against FLAP. Human and mouse FLAP-encoding DNA was amplified by polymerase chai...				US Patent US9732093 (2017) BindingDB Entry DOI: 10.7270/Q2NV9MCX
					More data for this Ligand-Target Pair
Flap endonuclease 1 (Homo sapiens (Human))	BDBM167159 (US9073876, 241 | US9732093, Compound 241) Show SMILES Nc1cnc(cn1)-c1ccc(C2CCC2)c(Oc2nccc(n2)N2CCC3(CC2)OCCCO3)c1F Show InChI InChI=1S/C26H29FN6O3/c27-23-19(20-15-31-21(28)16-30-20)6-5-18(17-3-1-4-17)24(23)36-25-29-10-7-22(32-25)33-11-8-26(9-12-33)34-13-2-14-35-26/h5-7,10,15-17H,1-4,8-9,11-14H2,(H2,28,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
JANSSEN PHARMACEUTICA NV US Patent					Assay Description The assay below is used to test the modulatory activity of compounds against FLAP. Human and mouse FLAP-encoding DNA was amplified by polymerase chai...				US Patent US9732093 (2017) BindingDB Entry DOI: 10.7270/Q2NV9MCX
					More data for this Ligand-Target Pair