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BDBM87344 4-[2-(4-chlorophenyl)ethylsulfamoyl]-1H-pyrrole-2-carboxylic acid methyl ester::MLS001123615::SMR000627577::cid_22551871::methyl 4-[2-(4-chlorophenyl)ethylsulfamoyl]-1H-pyrrole-2-carboxylate

SMILES: COC(=O)c1cc(c[nH]1)S(=O)(=O)NCCc1ccc(Cl)cc1

InChI Key: InChIKey=RJKHJOQVIAEKDT-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 = 87344   
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
nuclear receptor coactivator 3 isoform a


(Homo sapiens (Human))
BDBM87344
PNG
(4-[2-(4-chlorophenyl)ethylsulfamoyl]-1H-pyrrole-2-...)
Show SMILES COC(=O)c1cc(c[nH]1)S(=O)(=O)NCCc1ccc(Cl)cc1
Show InChI InChI=1S/C14H15ClN2O4S/c1-21-14(18)13-8-12(9-16-13)22(19,20)17-7-6-10-2-4-11(15)5-3-10/h2-5,8-9,16-17H,6-7H2,1H3
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PC sid
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PCBioAssay
n/an/a 5.72E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2HT2MXV
More data for this
Ligand-Target Pair
Nuclear receptor coactivator 1


(Homo sapiens (Human))
BDBM87344
PNG
(4-[2-(4-chlorophenyl)ethylsulfamoyl]-1H-pyrrole-2-...)
Show SMILES COC(=O)c1cc(c[nH]1)S(=O)(=O)NCCc1ccc(Cl)cc1
Show InChI InChI=1S/C14H15ClN2O4S/c1-21-14(18)13-8-12(9-16-13)22(19,20)17-7-6-10-2-4-11(15)5-3-10/h2-5,8-9,16-17H,6-7H2,1H3
PDB
MMDB

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antibodypedia
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PCBioAssay
n/an/a 1.00E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q28914F2
More data for this
Ligand-Target Pair
Alpha trans-inducing protein (VP16)


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM87344
PNG
(4-[2-(4-chlorophenyl)ethylsulfamoyl]-1H-pyrrole-2-...)
Show SMILES COC(=O)c1cc(c[nH]1)S(=O)(=O)NCCc1ccc(Cl)cc1
Show InChI InChI=1S/C14H15ClN2O4S/c1-21-14(18)13-8-12(9-16-13)22(19,20)17-7-6-10-2-4-11(15)5-3-10/h2-5,8-9,16-17H,6-7H2,1H3
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.18E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2D21W6V
More data for this
Ligand-Target Pair