BDBM50375361 CHEMBL260157
SMILES: COc1cc(Nc2nn3c(N[C@H](CO)Cc4c[nH]c5ccccc45)cc(nc3c2C(N)=O)C2CC2)cc(OC)c1
InChI Key: InChIKey=DCEQSZVKUPSCQE-IBGZPJMESA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50375361 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 |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50375361
(CHEMBL260157)Show SMILES COc1cc(Nc2nn3c(N[C@H](CO)Cc4c[nH]c5ccccc45)cc(nc3c2C(N)=O)C2CC2)cc(OC)c1 Show InChI InChI=1S/C29H31N7O4/c1-39-20-10-18(11-21(12-20)40-2)33-28-26(27(30)38)29-34-24(16-7-8-16)13-25(36(29)35-28)32-19(15-37)9-17-14-31-23-6-4-3-5-22(17)23/h3-6,10-14,16,19,31-32,37H,7-9,15H2,1-2H3,(H2,30,38)(H,33,35)/t19-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Company Ltd
Curated by ChEMBL
| Assay Description Inhibition of human cSrc in COS7 cells by ELISA |
Bioorg Med Chem 16: 909-21 (2008)
Article DOI: 10.1016/j.bmc.2007.10.068 BindingDB Entry DOI: 10.7270/Q2CF9R01 |
More data for this Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50375361
(CHEMBL260157)Show SMILES COc1cc(Nc2nn3c(N[C@H](CO)Cc4c[nH]c5ccccc45)cc(nc3c2C(N)=O)C2CC2)cc(OC)c1 Show InChI InChI=1S/C29H31N7O4/c1-39-20-10-18(11-21(12-20)40-2)33-28-26(27(30)38)29-34-24(16-7-8-16)13-25(36(29)35-28)32-19(15-37)9-17-14-31-23-6-4-3-5-22(17)23/h3-6,10-14,16,19,31-32,37H,7-9,15H2,1-2H3,(H2,30,38)(H,33,35)/t19-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Company Ltd
Curated by ChEMBL
| Assay Description Inhibition of human cSrc |
Bioorg Med Chem 16: 909-21 (2008)
Article DOI: 10.1016/j.bmc.2007.10.068 BindingDB Entry DOI: 10.7270/Q2CF9R01 |
More data for this Ligand-Target Pair | |