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BDBM15619 4-(4-(3-Chlorophenyl)-1H-pyrazol-3-yl)-N-((1-ethylpyrrolidin-2-yl)methyl)-1H-pyrrole-2-carboxamide::4-[4-(3-chlorophenyl)-1H-pyrazol-3-yl]-N-[(1-ethylpyrrolidin-2-yl)methyl]-1H-pyrrole-2-carboxamide::Pyrrole Carboxamide Analog 5e

SMILES: CCN1CCCC1CNC(=O)c1cc(c[nH]1)-c1n[nH]cc1-c1cccc(Cl)c1

InChI Key: InChIKey=FYNXWPSWTKNQFN-UHFFFAOYSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 15619   
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
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM15619
PNG
(4-(4-(3-Chlorophenyl)-1H-pyrazol-3-yl)-N-((1-ethyl...)
Show SMILES CCN1CCCC1CNC(=O)c1cc(c[nH]1)-c1n[nH]cc1-c1cccc(Cl)c1
Show InChI InChI=1S/C21H24ClN5O/c1-2-27-8-4-7-17(27)12-24-21(28)19-10-15(11-23-19)20-18(13-25-26-20)14-5-3-6-16(22)9-14/h3,5-6,9-11,13,17,23H,2,4,7-8,12H2,1H3,(H,24,28)(H,25,26)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
>4.00E+3n/an/an/an/an/an/an/an/a



Vertex



Assay Description
A coupled spectrophotometric assay was used in which ADP generated by JNK3 was converted to ATP by pyruvate kinase with the production of pyruvate fr...


J Med Chem 50: 1280-7 (2007)


Article DOI: 10.1021/jm061381f
BindingDB Entry DOI: 10.7270/Q2BR8QFV
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM15619
PNG
(4-(4-(3-Chlorophenyl)-1H-pyrazol-3-yl)-N-((1-ethyl...)
Show SMILES CCN1CCCC1CNC(=O)c1cc(c[nH]1)-c1n[nH]cc1-c1cccc(Cl)c1
Show InChI InChI=1S/C21H24ClN5O/c1-2-27-8-4-7-17(27)12-24-21(28)19-10-15(11-23-19)20-18(13-25-26-20)14-5-3-6-16(22)9-14/h3,5-6,9-11,13,17,23H,2,4,7-8,12H2,1H3,(H,24,28)(H,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
>1.00E+4>-6.93n/an/an/an/an/a7.530



Vertex



Assay Description
A coupled spectrophotometric assay was used in which ADP generated by ERK2 was converted to ATP by pyruvate kinase with the production of pyruvate fr...


J Med Chem 50: 1280-7 (2007)


Article DOI: 10.1021/jm061381f
BindingDB Entry DOI: 10.7270/Q2BR8QFV
More data for this
Ligand-Target Pair