BDBM50444362 CHEMBL3094465
SMILES: COc1ncc2cc(C(=O)Nc3cc(ccc3Cl)C(=O)NC(CCN(C)C)c3cccc(Cl)c3)c(=O)[nH]c2n1
InChI Key: InChIKey=GFSFWVNETAIFJQ-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50444362 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 1B
(Homo sapiens (Human)) | BDBM50444362
(CHEMBL3094465)Show SMILES COc1ncc2cc(C(=O)Nc3cc(ccc3Cl)C(=O)NC(CCN(C)C)c3cccc(Cl)c3)c(=O)[nH]c2n1 Show InChI InChI=1S/C27H26Cl2N6O4/c1-35(2)10-9-21(15-5-4-6-18(28)11-15)31-24(36)16-7-8-20(29)22(13-16)32-25(37)19-12-17-14-30-27(39-3)34-23(17)33-26(19)38/h4-8,11-14,21H,9-10H2,1-3H3,(H,31,36)(H,32,37)(H,30,33,34,38) | UniProtKB/SwissProt
UniProtKB/TrEMBL
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 233 | n/a | n/a | n/a | n/a | n/a | n/a |
Hoffmann-La Roche Inc.
Curated by ChEMBL
| Assay Description
Inhibition of DYRK1B (unknown origin) |
Bioorg Med Chem Lett 23: 6610-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.10.055
BindingDB Entry DOI: 10.7270/Q20G3MNJ |
More data for this
Ligand-Target Pair | |
Dual specificity tyrosine-phosphorylation-regulated kinase 1A
(Homo sapiens (Human)) | BDBM50444362
(CHEMBL3094465)Show SMILES COc1ncc2cc(C(=O)Nc3cc(ccc3Cl)C(=O)NC(CCN(C)C)c3cccc(Cl)c3)c(=O)[nH]c2n1 Show InChI InChI=1S/C27H26Cl2N6O4/c1-35(2)10-9-21(15-5-4-6-18(28)11-15)31-24(36)16-7-8-20(29)22(13-16)32-25(37)19-12-17-14-30-27(39-3)34-23(17)33-26(19)38/h4-8,11-14,21H,9-10H2,1-3H3,(H,31,36)(H,32,37)(H,30,33,34,38) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 156 | n/a | n/a | n/a | n/a | n/a | n/a |
Hoffmann-La Roche Inc.
Curated by ChEMBL
| Assay Description
Inhibition of DYRK1A (unknown origin) |
Bioorg Med Chem Lett 23: 6610-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.10.055
BindingDB Entry DOI: 10.7270/Q20G3MNJ |
More data for this
Ligand-Target Pair | |
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