BDBM50401439 CHEMBL2207504
SMILES: Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4cncnc4)CC3)c2[nH]1
InChI Key: InChIKey=NKTOEINNBIDTOF-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50401439 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 |
|---|
Receptor-type tyrosine-protein kinase FLT3
(Homo sapiens (Human)) | BDBM50401439
(CHEMBL2207504)Show SMILES Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4cncnc4)CC3)c2[nH]1 Show InChI InChI=1S/C20H22ClN9/c1-13-15(11-28(2)27-13)19-25-17-18(16(21)9-24-20(17)26-19)30-5-3-29(4-6-30)10-14-7-22-12-23-8-14/h7-9,11-12H,3-6,10H2,1-2H3,(H,24,25,26) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 5.90 | n/a | n/a | n/a | n/a | n/a |
The Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Binding affinity to FLT3 |
J Med Chem 55: 8721-34 (2012)
Article DOI: 10.1021/jm300952s
BindingDB Entry DOI: 10.7270/Q22J6D2W |
More data for this
Ligand-Target Pair | |
Aurora kinase A
(Homo sapiens (Human)) | BDBM50401439
(CHEMBL2207504)Show SMILES Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4cncnc4)CC3)c2[nH]1 Show InChI InChI=1S/C20H22ClN9/c1-13-15(11-28(2)27-13)19-25-17-18(16(21)9-24-20(17)26-19)30-5-3-29(4-6-30)10-14-7-22-12-23-8-14/h7-9,11-12H,3-6,10H2,1-2H3,(H,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
The Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Binding affinity to Aurora A kinase |
J Med Chem 55: 8721-34 (2012)
Article DOI: 10.1021/jm300952s
BindingDB Entry DOI: 10.7270/Q22J6D2W |
More data for this
Ligand-Target Pair | |
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