BDBM50503019 CHEMBL4564217
SMILES: CC(=O)Nc1cc(ccn1)-c1[nH]c(nc1-c1ccc(F)cc1)C(N)=O
InChI Key: InChIKey=ZWAPUYGIROZERD-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50503019 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50503019
(CHEMBL4564217)Show SMILES CC(=O)Nc1cc(ccn1)-c1[nH]c(nc1-c1ccc(F)cc1)C(N)=O Show InChI InChI=1S/C17H14FN5O2/c1-9(24)21-13-8-11(6-7-20-13)15-14(22-17(23-15)16(19)25)10-2-4-12(18)5-3-10/h2-8H,1H3,(H2,19,25)(H,22,23)(H,20,21,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 47 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard Karls Universit£t T£bingen
Curated by ChEMBL
| Assay Description
Inhibition of GSK3beta (unknown origin) by ADP-Glo assay |
ACS Med Chem Lett 10: 1407-1414 (2019)
Article DOI: 10.1021/acsmedchemlett.9b00177 |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50503019
(CHEMBL4564217)Show SMILES CC(=O)Nc1cc(ccn1)-c1[nH]c(nc1-c1ccc(F)cc1)C(N)=O Show InChI InChI=1S/C17H14FN5O2/c1-9(24)21-13-8-11(6-7-20-13)15-14(22-17(23-15)16(19)25)10-2-4-12(18)5-3-10/h2-8H,1H3,(H2,19,25)(H,22,23)(H,20,21,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 117 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard Karls Universit£t T£bingen
Curated by ChEMBL
| Assay Description
Inhibition of P38alpha MAPK (unknown origin) by ADP-Glo assay |
ACS Med Chem Lett 10: 1407-1414 (2019)
Article DOI: 10.1021/acsmedchemlett.9b00177 |
More data for this
Ligand-Target Pair | |
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