BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 5 hits with Last Name = 'liparulo' and Initial = 'a'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50152151
PNG
(CHEMBL3781006)
Show SMILES OC(=O)c1noc(c1-c1ccc(Cl)cc1)-c1ccc(OCc2ccc3ccccc3n2)cc1
Show InChI InChI=1S/C26H17ClN2O4/c27-19-10-5-17(6-11-19)23-24(26(30)31)29-33-25(23)18-8-13-21(14-9-18)32-15-20-12-7-16-3-1-2-4-22(16)28-20/h1-14H,15H2,(H,30,31)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 65n/an/an/an/an/an/a



University of Campania "Luigi Vanvitelli"

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX (unknown origin)


Eur J Med Chem 153: 65-72 (2018)


Article DOI: 10.1016/j.ejmech.2017.10.020
BindingDB Entry DOI: 10.7270/Q26H4M0M
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM153384
PNG
(4-(4-fluorophenyl)-7-[[[5-[(2S)-1,1,1-trifluoro-2-...)
Show SMILES CC[C@](O)(c1nnc(NCc2ccc3c(cc(=O)oc3c2)-c2ccc(F)cc2)o1)C(F)(F)F
Show InChI InChI=1S/C22H17F4N3O4/c1-2-21(31,22(24,25)26)19-28-29-20(33-19)27-11-12-3-8-15-16(10-18(30)32-17(15)9-12)13-4-6-14(23)7-5-13/h3-10,31H,2,11H2,1H3,(H,27,29)/t21-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 65n/an/an/an/an/an/a



University of Campania "Luigi Vanvitelli"

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX (unknown origin)


Eur J Med Chem 153: 65-72 (2018)


Article DOI: 10.1016/j.ejmech.2017.10.020
BindingDB Entry DOI: 10.7270/Q26H4M0M
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50369677
PNG
(CHEMBL4172824)
Show SMILES Cc1cc(Nc2ncc(o2)-c2ccc(F)cc2)cc(C)c1O
Show InChI InChI=1S/C17H15FN2O2/c1-10-7-14(8-11(2)16(10)21)20-17-19-9-15(22-17)12-3-5-13(18)6-4-12/h3-9,21H,1-2H3,(H,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 65n/an/an/an/an/an/a



University of Campania "Luigi Vanvitelli"

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX (unknown origin)


Eur J Med Chem 153: 65-72 (2018)


Article DOI: 10.1016/j.ejmech.2017.10.020
BindingDB Entry DOI: 10.7270/Q26H4M0M
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50369676
PNG
(CHEMBL4161423)
Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(SCCN(O)C(N)=O)nn1-c1ccc(Br)cc1
Show InChI InChI=1S/C18H18BrN5O4S2/c1-30(27,28)15-8-2-12(3-9-15)16-21-18(29-11-10-23(26)17(20)25)22-24(16)14-6-4-13(19)5-7-14/h2-9,26H,10-11H2,1H3,(H2,20,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 150n/an/an/an/an/an/a



University of Campania "Luigi Vanvitelli"

Curated by ChEMBL


Assay Description
Inhibition of COX2 (unknown origin)


Eur J Med Chem 153: 65-72 (2018)


Article DOI: 10.1016/j.ejmech.2017.10.020
BindingDB Entry DOI: 10.7270/Q26H4M0M
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50369676
PNG
(CHEMBL4161423)
Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(SCCN(O)C(N)=O)nn1-c1ccc(Br)cc1
Show InChI InChI=1S/C18H18BrN5O4S2/c1-30(27,28)15-8-2-12(3-9-15)16-21-18(29-11-10-23(26)17(20)25)22-24(16)14-6-4-13(19)5-7-14/h2-9,26H,10-11H2,1H3,(H2,20,25)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 850n/an/an/an/an/an/a



University of Campania "Luigi Vanvitelli"

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX (unknown origin)


Eur J Med Chem 153: 65-72 (2018)


Article DOI: 10.1016/j.ejmech.2017.10.020
BindingDB Entry DOI: 10.7270/Q26H4M0M
More data for this
Ligand-Target Pair