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BDBM67405 (1-p-cumenylsulfonylbenzimidazol-2-yl)amine::1-(4-propan-2-ylphenyl)sulfonyl-2-benzimidazolamine::1-(4-propan-2-ylphenyl)sulfonylbenzimidazol-2-amine::MLS-0435749.0001::cid_45253889

SMILES: CC(C)c1ccc(cc1)S(=O)(=O)n1c(N)nc2ccccc12

InChI Key: InChIKey=OIAMQNHAOKMRJZ-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 = 67405   
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))
BDBM67405
PNG
((1-p-cumenylsulfonylbenzimidazol-2-yl)amine | 1-(4...)
Show SMILES CC(C)c1ccc(cc1)S(=O)(=O)n1c(N)nc2ccccc12
Show InChI InChI=1S/C16H17N3O2S/c1-11(2)12-7-9-13(10-8-12)22(20,21)19-15-6-4-3-5-14(15)18-16(19)17/h3-11H,1-2H3,(H2,17,18)
PDB
MMDB

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B.MOAD
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 495n/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))
BDBM67405
PNG
((1-p-cumenylsulfonylbenzimidazol-2-yl)amine | 1-(4...)
Show SMILES CC(C)c1ccc(cc1)S(=O)(=O)n1c(N)nc2ccccc12
Show InChI InChI=1S/C16H17N3O2S/c1-11(2)12-7-9-13(10-8-12)22(20,21)19-15-6-4-3-5-14(15)18-16(19)17/h3-11H,1-2H3,(H2,17,18)
PDB
MMDB

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UniProtKB/TrEMBL

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antibodypedia
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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))
BDBM67405
PNG
((1-p-cumenylsulfonylbenzimidazol-2-yl)amine | 1-(4...)
Show SMILES CC(C)c1ccc(cc1)S(=O)(=O)n1c(N)nc2ccccc12
Show InChI InChI=1S/C16H17N3O2S/c1-11(2)12-7-9-13(10-8-12)22(20,21)19-15-6-4-3-5-14(15)18-16(19)17/h3-11H,1-2H3,(H2,17,18)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
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