BindingDB logo
myBDB logout

BDBM67400 2-(4-chlorophenyl)sulfonyl-5-(3,4-dimethoxyphenyl)-3-pyrazolamine::2-(4-chlorophenyl)sulfonyl-5-(3,4-dimethoxyphenyl)pyrazol-3-amine::MLS-0067135.0001::[2-(4-chlorophenyl)sulfonyl-5-(3,4-dimethoxyphenyl)pyrazol-3-yl]amine::cid_16654629

SMILES: COc1ccc(cc1OC)-c1cc(N)n(n1)S(=O)(=O)c1ccc(Cl)cc1

InChI Key: InChIKey=GZFBCKOHLMVQMI-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 67400   
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
nucleotide-binding oligomerization domain containing 1


(Homo sapiens (Human))
BDBM67400
PNG
(2-(4-chlorophenyl)sulfonyl-5-(3,4-dimethoxyphenyl)...)
Show SMILES COc1ccc(cc1OC)-c1cc(N)n(n1)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H16ClN3O4S/c1-24-15-8-3-11(9-16(15)25-2)14-10-17(19)21(20-14)26(22,23)13-6-4-12(18)5-7-13/h3-10H,19H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>2.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q23J3BDQ
More data for this
Ligand-Target Pair
Tumor necrosis factor


(Homo sapiens (Human))
BDBM67400
PNG
(2-(4-chlorophenyl)sulfonyl-5-(3,4-dimethoxyphenyl)...)
Show SMILES COc1ccc(cc1OC)-c1cc(N)n(n1)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H16ClN3O4S/c1-24-15-8-3-11(9-16(15)25-2)14-10-17(19)21(20-14)26(22,23)13-6-4-12(18)5-7-13/h3-10H,19H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>2.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2V1237V
More data for this
Ligand-Target Pair
nucleotide-binding oligomerization domain containing 2


(Homo sapiens (Human))
BDBM67400
PNG
(2-(4-chlorophenyl)sulfonyl-5-(3,4-dimethoxyphenyl)...)
Show SMILES COc1ccc(cc1OC)-c1cc(N)n(n1)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H16ClN3O4S/c1-24-15-8-3-11(9-16(15)25-2)14-10-17(19)21(20-14)26(22,23)13-6-4-12(18)5-7-13/h3-10H,19H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>2.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2ZS2TX1
More data for this
Ligand-Target Pair