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BDBM50162999 3-[1-(3-Dimethylamino-propyl)-1H-indazol-3-yl]-4-(1-vinyl-1H-indol-3-yl)-pyrrole-2,5-dione::CHEMBL368193

SMILES: CN(C)CCCn1nc(C2=C(C(=O)NC2=O)c2cn(C=C)c3ccccc23)c2ccccc12

InChI Key: InChIKey=IIMMUGRHSXMDBU-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50162999   
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
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50162999
PNG
(3-[1-(3-Dimethylamino-propyl)-1H-indazol-3-yl]-4-(...)
Show SMILES CN(C)CCCn1nc(C2=C(C(=O)NC2=O)c2cn(C=C)c3ccccc23)c2ccccc12 |t:9|
Show InChI InChI=1S/C26H25N5O2/c1-4-30-16-19(17-10-5-7-12-20(17)30)22-23(26(33)27-25(22)32)24-18-11-6-8-13-21(18)31(28-24)15-9-14-29(2)3/h4-8,10-13,16H,1,9,14-15H2,2-3H3,(H,27,32,33)
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PC sid
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Article
PubMed
n/an/a 250n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research & Development

Curated by ChEMBL


Assay Description
Inhibition of human Protein kinase C alpha using [gamma-33P]-ATP


J Med Chem 48: 1725-8 (2005)


Article DOI: 10.1021/jm049478u
BindingDB Entry DOI: 10.7270/Q2765DVX
More data for this
Ligand-Target Pair
Protein kinase C, gamma


(Homo sapiens (Human))
BDBM50162999
PNG
(3-[1-(3-Dimethylamino-propyl)-1H-indazol-3-yl]-4-(...)
Show SMILES CN(C)CCCn1nc(C2=C(C(=O)NC2=O)c2cn(C=C)c3ccccc23)c2ccccc12 |t:9|
Show InChI InChI=1S/C26H25N5O2/c1-4-30-16-19(17-10-5-7-12-20(17)30)22-23(26(33)27-25(22)32)24-18-11-6-8-13-21(18)31(28-24)15-9-14-29(2)3/h4-8,10-13,16H,1,9,14-15H2,2-3H3,(H,27,32,33)
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Article
PubMed
n/an/a 320n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research & Development

Curated by ChEMBL


Assay Description
Inhibition of human Protein kinase C gamma using [gamma-33P]-ATP


J Med Chem 48: 1725-8 (2005)


Article DOI: 10.1021/jm049478u
BindingDB Entry DOI: 10.7270/Q2765DVX
More data for this
Ligand-Target Pair
PKC alpha and beta-2


(Homo sapiens (Human))
BDBM50162999
PNG
(3-[1-(3-Dimethylamino-propyl)-1H-indazol-3-yl]-4-(...)
Show SMILES CN(C)CCCn1nc(C2=C(C(=O)NC2=O)c2cn(C=C)c3ccccc23)c2ccccc12 |t:9|
Show InChI InChI=1S/C26H25N5O2/c1-4-30-16-19(17-10-5-7-12-20(17)30)22-23(26(33)27-25(22)32)24-18-11-6-8-13-21(18)31(28-24)15-9-14-29(2)3/h4-8,10-13,16H,1,9,14-15H2,2-3H3,(H,27,32,33)
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PC sid
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Article
PubMed
n/an/a 23n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research & Development

Curated by ChEMBL


Assay Description
Inhibition of IL-8 release by HEK293 cells expressing PKC-beta2


J Med Chem 48: 1725-8 (2005)


Article DOI: 10.1021/jm049478u
BindingDB Entry DOI: 10.7270/Q2765DVX
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM50162999
PNG
(3-[1-(3-Dimethylamino-propyl)-1H-indazol-3-yl]-4-(...)
Show SMILES CN(C)CCCn1nc(C2=C(C(=O)NC2=O)c2cn(C=C)c3ccccc23)c2ccccc12 |t:9|
Show InChI InChI=1S/C26H25N5O2/c1-4-30-16-19(17-10-5-7-12-20(17)30)22-23(26(33)27-25(22)32)24-18-11-6-8-13-21(18)31(28-24)15-9-14-29(2)3/h4-8,10-13,16H,1,9,14-15H2,2-3H3,(H,27,32,33)
PDB
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 49n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research & Development

Curated by ChEMBL


Assay Description
Inhibition of rabbit Glycogen synthase kinase-3 beta


J Med Chem 48: 1725-8 (2005)


Article DOI: 10.1021/jm049478u
BindingDB Entry DOI: 10.7270/Q2765DVX
More data for this
Ligand-Target Pair