BDBM50503012 CHEMBL4529679
SMILES: NC(=O)c1nc(c([nH]1)-c1ccnc(NC(=O)C2CC2)c1)-c1cccc(OC(F)(F)F)c1
InChI Key: InChIKey=ZUOGMOOYZHKZLK-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50503012 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 |
|---|
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50503012
(CHEMBL4529679)Show SMILES NC(=O)c1nc(c([nH]1)-c1ccnc(NC(=O)C2CC2)c1)-c1cccc(OC(F)(F)F)c1 Show InChI InChI=1S/C20H16F3N5O3/c21-20(22,23)31-13-3-1-2-11(8-13)15-16(28-18(27-15)17(24)29)12-6-7-25-14(9-12)26-19(30)10-4-5-10/h1-3,6-10H,4-5H2,(H2,24,29)(H,27,28)(H,25,26,30) | 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 | 2.04E+3 | 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 | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50503012
(CHEMBL4529679)Show SMILES NC(=O)c1nc(c([nH]1)-c1ccnc(NC(=O)C2CC2)c1)-c1cccc(OC(F)(F)F)c1 Show InChI InChI=1S/C20H16F3N5O3/c21-20(22,23)31-13-3-1-2-11(8-13)15-16(28-18(27-15)17(24)29)12-6-7-25-14(9-12)26-19(30)10-4-5-10/h1-3,6-10H,4-5H2,(H2,24,29)(H,27,28)(H,25,26,30) | 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 | 352 | 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 | |
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