BDBM50095229 7-(3-Morpholin-4-yl-propoxy)-4-(4-phenoxy-phenylamino)-quinoline-3-carbonitrile::CHEMBL94965
SMILES: N#Cc1cnc2cc(OCCCN3CCOCC3)ccc2c1Nc1ccc(Oc2ccccc2)cc1
InChI Key: InChIKey=NRIBQLACPGHUAA-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50095229 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 RAF and Dual specificity mitogen-activated protein kinase kinase 1 (Raf/MEK)
(Homo sapiens (Human)) | BDBM50095229
(7-(3-Morpholin-4-yl-propoxy)-4-(4-phenoxy-phenylam...)Show SMILES N#Cc1cnc2cc(OCCCN3CCOCC3)ccc2c1Nc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C29H28N4O3/c30-20-22-21-31-28-19-26(35-16-4-13-33-14-17-34-18-15-33)11-12-27(28)29(22)32-23-7-9-25(10-8-23)36-24-5-2-1-3-6-24/h1-3,5-12,19,21H,4,13-18H2,(H,31,32) | PDB
MMDB
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth-Ayerst Research
Curated by ChEMBL
| Assay Description
Inhibition of ERK-phosphorylation by Raf-MEK-ERK in coupled ELISA |
Bioorg Med Chem Lett 10: 2825-8 (2000)
BindingDB Entry DOI: 10.7270/Q22N51J8 |
More data for this
Ligand-Target Pair | |
Dual specificity mitogen-activated protein kinase kinase 1
(Homo sapiens (Human)) | BDBM50095229
(7-(3-Morpholin-4-yl-propoxy)-4-(4-phenoxy-phenylam...)Show SMILES N#Cc1cnc2cc(OCCCN3CCOCC3)ccc2c1Nc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C29H28N4O3/c30-20-22-21-31-28-19-26(35-16-4-13-33-14-17-34-18-15-33)11-12-27(28)29(22)32-23-7-9-25(10-8-23)36-24-5-2-1-3-6-24/h1-3,5-12,19,21H,4,13-18H2,(H,31,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 68 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth-Ayerst Research
Curated by ChEMBL
| Assay Description
Inhibition of ERK-phosphorylation by MEK-ERK in direct ELISA |
Bioorg Med Chem Lett 10: 2825-8 (2000)
BindingDB Entry DOI: 10.7270/Q22N51J8 |
More data for this
Ligand-Target Pair | |
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