Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 538.4 BDBM145709

Wt: 538.4 BDBM171988

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Arachidonate 5-lipoxygenase-activating protein (Homo sapiens (Human))	BDBM145709 (US8952177, 63) Show SMILES Cc1ccc(COc2cc(F)c3nc(C4[C@H](C(O)=O)C4(C)C)n(Cc4ccc(Br)cc4)c3c2)nc1 |r| Show InChI InChI=1S/C27H25BrFN3O3/c1-15-4-9-18(30-12-15)14-35-19-10-20(29)24-21(11-19)32(13-16-5-7-17(28)8-6-16)25(31-24)22-23(26(33)34)27(22,2)3/h4-12,22-23H,13-14H2,1-3H3,(H,33,34)/t22?,23-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	23	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description FLAP-containing membranes were prepared as was a FITC-labeled FLAP modulator (3-(3-(tert-butylthio)-1-(4-chlorobenzyl)-5-(quinolin-2-ylmethoxy)-1H-in...				US Patent US8952177 (2015) BindingDB Entry DOI: 10.7270/Q2G73CFW
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase-activating protein (Homo sapiens (Human))	BDBM171988 (US9089569, 63 | US9695149, 63) Show SMILES Cc1ccc(COc2cc(F)c3nc([C@@H]4[C@H](C(O)=O)C4(C)C)n(Cc4ccc(Br)cc4)c3c2)nc1 |r| Show InChI InChI=1S/C27H25BrFN3O3/c1-15-4-9-18(30-12-15)14-35-19-10-20(29)24-21(11-19)32(13-16-5-7-17(28)8-6-16)25(31-24)22-23(26(33)34)27(22,2)3/h4-12,22-23H,13-14H2,1-3H3,(H,33,34)/t22-,23+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	23	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 US9695149 (2017) BindingDB Entry DOI: 10.7270/Q2Q52MSC
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase-activating protein (Homo sapiens (Human))	BDBM171988 (US9089569, 63 | US9695149, 63) Show SMILES Cc1ccc(COc2cc(F)c3nc([C@@H]4[C@H](C(O)=O)C4(C)C)n(Cc4ccc(Br)cc4)c3c2)nc1 |r| Show InChI InChI=1S/C27H25BrFN3O3/c1-15-4-9-18(30-12-15)14-35-19-10-20(29)24-21(11-19)32(13-16-5-7-17(28)8-6-16)25(31-24)22-23(26(33)34)27(22,2)3/h4-12,22-23H,13-14H2,1-3H3,(H,33,34)/t22-,23+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	23	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 US9089569 (2015) BindingDB Entry DOI: 10.7270/Q23X85DB
					More data for this Ligand-Target Pair