BDBM50445253 CHEMBL1232500
SMILES: CCN1C(Sc2ccc(O)cc12)=CC(C)=O
InChI Key: InChIKey=GCSZJMUFYOAHFY-UHFFFAOYSA-N
Data: 3 IC50
PDB links: 1 PDB ID matches this monomer.
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 3 hits for monomerid = 50445253 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 |
Dual-specificity tyrosine-phosphorylation regulated kinase 1A
(Homo sapiens (Human)) | BDBM50445253
 (CHEMBL1232500)Show InChI InChI=1S/C12H13NO2S/c1-3-13-10-7-9(15)4-5-11(10)16-12(13)6-8(2)14/h4-7,15H,3H2,1-2H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | 240 | n/a | n/a | n/a | n/a | n/a | n/a |
India Academy of Scientific & Innovative Research (AcSIR)
Curated by ChEMBL
| Assay Description Inhibition of Dyrk1A (unknown origin) |
Bioorg Med Chem Lett 25: 2948-52 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.034 BindingDB Entry DOI: 10.7270/Q21V5GR3 |
More data for this Ligand-Target Pair |  3D Structure (crystal) |
Dual-specificity tyrosine-phosphorylation regulated kinase 1A
(Homo sapiens (Human)) | BDBM50445253
 (CHEMBL1232500)Show InChI InChI=1S/C12H13NO2S/c1-3-13-10-7-9(15)4-5-11(10)16-12(13)6-8(2)14/h4-7,15H,3H2,1-2H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Similars
| PDB PubMed
| n/a | n/a | 240 | n/a | n/a | n/a | n/a | n/a | n/a |
Seoul National University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant full length GST-tagged DYRK1A expressed in baculovirus expression system after 10 mins in presence of [gamma33P-ATP] ... |
J Med Chem 61: 9791-9810 (2018)
BindingDB Entry DOI: 10.7270/Q2H41V3Q |
More data for this Ligand-Target Pair |  3D Structure (crystal) |
Dual-specificity tyrosine-phosphorylation regulated kinase 1A
(Homo sapiens (Human)) | BDBM50445253
 (CHEMBL1232500)Show InChI InChI=1S/C12H13NO2S/c1-3-13-10-7-9(15)4-5-11(10)16-12(13)6-8(2)14/h4-7,15H,3H2,1-2H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | 240 | n/a | n/a | n/a | n/a | n/a | n/a |
UPR 2301, CNRS
Curated by ChEMBL
| Assay Description Competitive inhibition of DYRK1A (unknown origin) using ATP |
J Med Chem 56: 9569-85 (2014)
Article DOI: 10.1021/jm401049v BindingDB Entry DOI: 10.7270/Q2BG2QFT |
More data for this Ligand-Target Pair |  3D Structure (crystal) |