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BDBM272547 3-(2-methylpyridin-4-yl)-5,6-dihydro-1H-pyrazolo[4,3-g]quinazolin-7(8H)-one::US10065967, Example 13::US9745307, Example 13

SMILES: Cc1cc(ccn1)-c1n[nH]c2cc3NC(=O)NCc3cc12

InChI Key: InChIKey=FEIJZJGMKBIZGG-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 272547   
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 1


(Homo sapiens (Human))
BDBM272547
PNG
(3-(2-methylpyridin-4-yl)-5,6-dihydro-1H-pyrazolo[4...)
Show SMILES Cc1cc(ccn1)-c1n[nH]c2cc3NC(=O)NCc3cc12
Show InChI InChI=1S/C15H13N5O/c1-8-4-9(2-3-16-8)14-11-5-10-7-17-15(21)18-12(10)6-13(11)19-20-14/h2-6H,7H2,1H3,(H,19,20)(H2,17,18,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 0.600n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Activated ERK2 activity was determined in an IMAP-FP assay (Molecular Devices). Using this assay format, the potency (IC50) of each compound was dete...


US Patent US9745307 (2017)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM272547
PNG
(3-(2-methylpyridin-4-yl)-5,6-dihydro-1H-pyrazolo[4...)
Show SMILES Cc1cc(ccn1)-c1n[nH]c2cc3NC(=O)NCc3cc12
Show InChI InChI=1S/C15H13N5O/c1-8-4-9(2-3-16-8)14-11-5-10-7-17-15(21)18-12(10)6-13(11)19-20-14/h2-6H,7H2,1H3,(H,19,20)(H2,17,18,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 0.600n/an/an/an/an/an/a



Merck, Sharp & Dohme Corp.

US Patent


Assay Description
Activated ERK2 activity was determined in an IMAP-FP assay (Molecular Devices). Using this assay format, the potency (IC50) of each compound was dete...


US Patent US10065967 (2018)

More data for this
Ligand-Target Pair