BindingDB logo
myBDB logout

BDBM56150 (6E)-4-methyl-6-[5-(2-methylphenyl)-1,2-dihydropyrazol-3-ylidene]-1-cyclohexa-2,4-dienone::(6E)-4-methyl-6-[5-(2-methylphenyl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one::(6E)-4-methyl-6-[5-(o-tolyl)-3-pyrazolin-3-ylidene]cyclohexa-2,4-dien-1-one::4-methyl-2-[5-(2-methylphenyl)-1H-pyrazol-3-yl]phenol::MLS000099089::SMR000070479::cid_5405417

SMILES: Cc1ccc(O)c(c1)-c1cc([nH]n1)-c1ccccc1C

InChI Key: InChIKey=ZLYRBPNNXMKKGJ-UHFFFAOYSA-N

Data: 1 KI  6 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 7 hits for monomerid = 56150   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM56150
PNG
((6E)-4-methyl-6-[5-(2-methylphenyl)-1,2-dihydropyr...)
Show SMILES Cc1ccc(O)c(c1)-c1cc([nH]n1)-c1ccccc1C
Show InChI InChI=1S/C17H16N2O/c1-11-7-8-17(20)14(9-11)16-10-15(18-19-16)13-6-4-3-5-12(13)2/h3-10,20H,1-2H3,(H,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
1.00E+3n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Competitive inhibition of N-terminal His6-tagged human 12/15-LOX using arachidonic acid as substrate by Dixon plot analysis


Bioorg Med Chem 24: 1183-90 (2016)


Article DOI: 10.1016/j.bmc.2016.01.042
BindingDB Entry DOI: 10.7270/Q2QJ7K44
More data for this
Ligand-Target Pair
Cyclooxygenase


(Homo sapiens (human))
BDBM56150
PNG
((6E)-4-methyl-6-[5-(2-methylphenyl)-1,2-dihydropyr...)
Show SMILES Cc1ccc(O)c(c1)-c1cc([nH]n1)-c1ccccc1C
Show InChI InChI=1S/C17H16N2O/c1-11-7-8-17(20)14(9-11)16-10-15(18-19-16)13-6-4-3-5-12(13)2/h3-10,20H,1-2H3,(H,18,19)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of human COX-2 by UV-visible spectrophotometric analysis


Bioorg Med Chem 24: 1183-90 (2016)


Article DOI: 10.1016/j.bmc.2016.01.042
BindingDB Entry DOI: 10.7270/Q2QJ7K44
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM56150
PNG
((6E)-4-methyl-6-[5-(2-methylphenyl)-1,2-dihydropyr...)
Show SMILES Cc1ccc(O)c(c1)-c1cc([nH]n1)-c1ccccc1C
Show InChI InChI=1S/C17H16N2O/c1-11-7-8-17(20)14(9-11)16-10-15(18-19-16)13-6-4-3-5-12(13)2/h3-10,20H,1-2H3,(H,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 3.40E+3n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His6-tagged human 12/15-LOX using arachidonic acid as substrate by UV-visible spectrophotometric analysis


Bioorg Med Chem 24: 1183-90 (2016)


Article DOI: 10.1016/j.bmc.2016.01.042
BindingDB Entry DOI: 10.7270/Q2QJ7K44
More data for this
Ligand-Target Pair
15-Lipoxygenase-2 (15-LOX-2)


(Homo sapiens (Human))
BDBM56150
PNG
((6E)-4-methyl-6-[5-(2-methylphenyl)-1,2-dihydropyr...)
Show SMILES Cc1ccc(O)c(c1)-c1cc([nH]n1)-c1ccccc1C
Show InChI InChI=1S/C17H16N2O/c1-11-7-8-17(20)14(9-11)16-10-15(18-19-16)13-6-4-3-5-12(13)2/h3-10,20H,1-2H3,(H,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His6-tagged human 15-LOX-2 using arachidonic acid as substrate by UV-visible spectrophotometric analysis


Bioorg Med Chem 24: 1183-90 (2016)


Article DOI: 10.1016/j.bmc.2016.01.042
BindingDB Entry DOI: 10.7270/Q2QJ7K44
More data for this
Ligand-Target Pair
12-Lipoxygenase (12-LOX)


(Homo sapiens (Human))
BDBM56150
PNG
((6E)-4-methyl-6-[5-(2-methylphenyl)-1,2-dihydropyr...)
Show SMILES Cc1ccc(O)c(c1)-c1cc([nH]n1)-c1ccccc1C
Show InChI InChI=1S/C17H16N2O/c1-11-7-8-17(20)14(9-11)16-10-15(18-19-16)13-6-4-3-5-12(13)2/h3-10,20H,1-2H3,(H,18,19)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His6-tagged human 12-LOX using arachidonic acid as substrate by UV-visible spectrophotometric analysis


Bioorg Med Chem 24: 1183-90 (2016)


Article DOI: 10.1016/j.bmc.2016.01.042
BindingDB Entry DOI: 10.7270/Q2QJ7K44
More data for this
Ligand-Target Pair
Kallikrein 5


(Homo sapiens)
BDBM56150
PNG
((6E)-4-methyl-6-[5-(2-methylphenyl)-1,2-dihydropyr...)
Show SMILES Cc1ccc(O)c(c1)-c1cc([nH]n1)-c1ccccc1C
Show InChI InChI=1S/C17H16N2O/c1-11-7-8-17(20)14(9-11)16-10-15(18-19-16)13-6-4-3-5-12(13)2/h3-10,20H,1-2H3,(H,18,19)
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

PCBioAssay
n/an/a 5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2GH9GC8
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM56150
PNG
((6E)-4-methyl-6-[5-(2-methylphenyl)-1,2-dihydropyr...)
Show SMILES Cc1ccc(O)c(c1)-c1cc([nH]n1)-c1ccccc1C
Show InChI InChI=1S/C17H16N2O/c1-11-7-8-17(20)14(9-11)16-10-15(18-19-16)13-6-4-3-5-12(13)2/h3-10,20H,1-2H3,(H,18,19)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX using arachidonic acid as substrate by UV-visible spectrophotometric analysis


Bioorg Med Chem 24: 1183-90 (2016)


Article DOI: 10.1016/j.bmc.2016.01.042
BindingDB Entry DOI: 10.7270/Q2QJ7K44
More data for this
Ligand-Target Pair