BDBM50502994 CHEMBL4474740
SMILES: Cc1nc(c([nH]1)-c1ccnc(NC(=O)C2CC2)c1)-c1ccc(F)c(F)c1
InChI Key: InChIKey=JOIVAEYUULQRLW-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50502994 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)) | BDBM50502994
(CHEMBL4474740)Show SMILES Cc1nc(c([nH]1)-c1ccnc(NC(=O)C2CC2)c1)-c1ccc(F)c(F)c1 Show InChI InChI=1S/C19H16F2N4O/c1-10-23-17(12-4-5-14(20)15(21)8-12)18(24-10)13-6-7-22-16(9-13)25-19(26)11-2-3-11/h4-9,11H,2-3H2,1H3,(H,23,24)(H,22,25,26) | 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 | 19 | 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)) | BDBM50502994
(CHEMBL4474740)Show SMILES Cc1nc(c([nH]1)-c1ccnc(NC(=O)C2CC2)c1)-c1ccc(F)c(F)c1 Show InChI InChI=1S/C19H16F2N4O/c1-10-23-17(12-4-5-14(20)15(21)8-12)18(24-10)13-6-7-22-16(9-13)25-19(26)11-2-3-11/h4-9,11H,2-3H2,1H3,(H,23,24)(H,22,25,26) | 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 | 59 | 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 | |