null
SMILES: Nc1n[nH]c2cccc(-c3ccc(cc3)C(=O)N3CCN(CC3)C(=O)c3ccc(Cl)cc3)c12
InChI Key: InChIKey=ZINZLVSCZRWBEX-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50131184 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 |
Breakpoint cluster region protein/Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50131184
![PNG](/data/jpeg/tenK5013/BindingDB_50131184.png) (CHEMBL3634535)Show SMILES Nc1n[nH]c2cccc(-c3ccc(cc3)C(=O)N3CCN(CC3)C(=O)c3ccc(Cl)cc3)c12 Show InChI InChI=1S/C25H22ClN5O2/c26-19-10-8-18(9-11-19)25(33)31-14-12-30(13-15-31)24(32)17-6-4-16(5-7-17)20-2-1-3-21-22(20)23(27)29-28-21/h1-11H,12-15H2,(H3,27,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| PubMed
| n/a | n/a | 1.89E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
First Affiliated Hospital of Xi'an Jiaotong University
Curated by ChEMBL
| Assay Description Inhibition constant against Adenosine A2a receptor |
Eur J Med Chem 104: 139-47 (2015)
BindingDB Entry DOI: 10.7270/Q23B61Z7 |
More data for this Ligand-Target Pair | |
Breakpoint cluster region protein/Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50131184
![PNG](/data/jpeg/tenK5013/BindingDB_50131184.png) (CHEMBL3634535)Show SMILES Nc1n[nH]c2cccc(-c3ccc(cc3)C(=O)N3CCN(CC3)C(=O)c3ccc(Cl)cc3)c12 Show InChI InChI=1S/C25H22ClN5O2/c26-19-10-8-18(9-11-19)25(33)31-14-12-30(13-15-31)24(32)17-6-4-16(5-7-17)20-2-1-3-21-22(20)23(27)29-28-21/h1-11H,12-15H2,(H3,27,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| PubMed
| n/a | n/a | 6.56E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
First Affiliated Hospital of Xi'an Jiaotong University
Curated by ChEMBL
| Assay Description Inhibitory concentration against interleukin-2 binding |
Eur J Med Chem 104: 139-47 (2015)
BindingDB Entry DOI: 10.7270/Q23B61Z7 |
More data for this Ligand-Target Pair | |