BDBM50414004 CHEMBL515751
SMILES: COCCN(C)CCc1ccc(cc1)-n1cc(-c2cccc(OC)c2)c2c(N)ncnc12
InChI Key: InChIKey=FAMYHPWZEGLNRZ-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50414004 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 |
|---|
Calmodulin/Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50414004
(CHEMBL515751)Show SMILES COCCN(C)CCc1ccc(cc1)-n1cc(-c2cccc(OC)c2)c2c(N)ncnc12 Show InChI InChI=1S/C25H29N5O2/c1-29(13-14-31-2)12-11-18-7-9-20(10-8-18)30-16-22(19-5-4-6-21(15-19)32-3)23-24(26)27-17-28-25(23)30/h4-10,15-17H,11-14H2,1-3H3,(H2,26,27,28) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of c-Src kinase (unknown origin) |
Citation and Details
Article DOI: 10.1007/s00044-012-0308-3
BindingDB Entry DOI: 10.7270/Q2BZ68ZH |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50414004
(CHEMBL515751)Show SMILES COCCN(C)CCc1ccc(cc1)-n1cc(-c2cccc(OC)c2)c2c(N)ncnc12 Show InChI InChI=1S/C25H29N5O2/c1-29(13-14-31-2)12-11-18-7-9-20(10-8-18)30-16-22(19-5-4-6-21(15-19)32-3)23-24(26)27-17-28-25(23)30/h4-10,15-17H,11-14H2,1-3H3,(H2,26,27,28) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Siena
Curated by ChEMBL
| Assay Description
Inhibition of c-Src |
Eur J Med Chem 44: 990-1000 (2009)
Article DOI: 10.1016/j.ejmech.2008.07.002
BindingDB Entry DOI: 10.7270/Q2ZC8434 |
More data for this
Ligand-Target Pair | |
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