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BDBM50184725 CHEMBL3824056

SMILES: Cc1ccc(O)cc1Nc1ccnc2ccc(cc12)C(=O)NCC1CCOCC1

InChI Key: InChIKey=QLSAXYFWMHAMER-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 = 50184725   
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
Serine/threonine-protein kinase RIPK2


(Homo sapiens (Human))
BDBM50184725
PNG
(CHEMBL3824056)
Show SMILES Cc1ccc(O)cc1Nc1ccnc2ccc(cc12)C(=O)NCC1CCOCC1
Show InChI InChI=1S/C23H25N3O3/c1-15-2-4-18(27)13-22(15)26-21-6-9-24-20-5-3-17(12-19(20)21)23(28)25-14-16-7-10-29-11-8-16/h2-6,9,12-13,16,27H,7-8,10-11,14H2,1H3,(H,24,26)(H,25,28)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 20n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Competitive inhibition of full length FLAG-His-tagged RIP2K (unknown origin) expressed in baculovirus expression system preincubated for 10 mins foll...


J Med Chem 59: 4867-80 (2016)


BindingDB Entry DOI: 10.7270/Q2G162SQ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50184725
PNG
(CHEMBL3824056)
Show SMILES Cc1ccc(O)cc1Nc1ccnc2ccc(cc12)C(=O)NCC1CCOCC1
Show InChI InChI=1S/C23H25N3O3/c1-15-2-4-18(27)13-22(15)26-21-6-9-24-20-5-3-17(12-19(20)21)23(28)25-14-16-7-10-29-11-8-16/h2-6,9,12-13,16,27H,7-8,10-11,14H2,1H3,(H,24,26)(H,25,28)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a>5.00E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2(unknown origin)


J Med Chem 59: 4867-80 (2016)


BindingDB Entry DOI: 10.7270/Q2G162SQ
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50184725
PNG
(CHEMBL3824056)
Show SMILES Cc1ccc(O)cc1Nc1ccnc2ccc(cc12)C(=O)NCC1CCOCC1
Show InChI InChI=1S/C23H25N3O3/c1-15-2-4-18(27)13-22(15)26-21-6-9-24-20-5-3-17(12-19(20)21)23(28)25-14-16-7-10-29-11-8-16/h2-6,9,12-13,16,27H,7-8,10-11,14H2,1H3,(H,24,26)(H,25,28)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a>5.00E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of p38alpha (unknown origin)


J Med Chem 59: 4867-80 (2016)


BindingDB Entry DOI: 10.7270/Q2G162SQ
More data for this
Ligand-Target Pair