BDBM50375271 CHEMBL272711
SMILES: COc1cc2NC(=O)c3ccc(cc3Nc2cc1CCC(=O)N(C)C)-c1ccc(c(OC)c1)[N+]([O-])=O
InChI Key: InChIKey=AGRVZUBNGZHHLY-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50375271 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 |
|---|
Serine/threonine-protein kinase Chk1
(Homo sapiens (Human)) | BDBM50375271
(CHEMBL272711)Show SMILES COc1cc2NC(=O)c3ccc(cc3Nc2cc1CCC(=O)N(C)C)-c1ccc(c(OC)c1)[N+]([O-])=O Show InChI InChI=1S/C26H26N4O6/c1-29(2)25(31)10-7-17-12-20-21(14-23(17)35-3)28-26(32)18-8-5-15(11-19(18)27-20)16-6-9-22(30(33)34)24(13-16)36-4/h5-6,8-9,11-14,27H,7,10H2,1-4H3,(H,28,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Chk1 |
Bioorg Med Chem Lett 18: 2311-5 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.080
BindingDB Entry DOI: 10.7270/Q2XG9S16 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase Chk1
(Homo sapiens (Human)) | BDBM50375271
(CHEMBL272711)Show SMILES COc1cc2NC(=O)c3ccc(cc3Nc2cc1CCC(=O)N(C)C)-c1ccc(c(OC)c1)[N+]([O-])=O Show InChI InChI=1S/C26H26N4O6/c1-29(2)25(31)10-7-17-12-20-21(14-23(17)35-3)28-26(32)18-8-5-15(11-19(18)27-20)16-6-9-22(30(33)34)24(13-16)36-4/h5-6,8-9,11-14,27H,7,10H2,1-4H3,(H,28,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 50 | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Chk1 in H1299 cells assessed as blockade of Cdc25A degradation |
Bioorg Med Chem Lett 18: 2311-5 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.080
BindingDB Entry DOI: 10.7270/Q2XG9S16 |
More data for this
Ligand-Target Pair | |
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