BDBM50355918 CHEMBL1910388
SMILES: CCN(CC)C(=O)c1cccc(c1)N1CCN(CC1)C(=O)c1c2ccccc2cc2ccccc12
InChI Key: InChIKey=KWLZPERNJAGQKZ-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50355918 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 |
|---|
Acetyl-CoA carboxylase 2 (ACC2)
(Homo sapiens (Human)) | BDBM50355918
(CHEMBL1910388)Show SMILES CCN(CC)C(=O)c1cccc(c1)N1CCN(CC1)C(=O)c1c2ccccc2cc2ccccc12 Show InChI InChI=1S/C30H31N3O2/c1-3-31(4-2)29(34)24-12-9-13-25(21-24)32-16-18-33(19-17-32)30(35)28-26-14-7-5-10-22(26)20-23-11-6-8-15-27(23)28/h5-15,20-21H,3-4,16-19H2,1-2H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
Takeda Pharmaceutical Company, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of human ACC2 |
Bioorg Med Chem Lett 21: 6314-8 (2011)
Article DOI: 10.1016/j.bmcl.2011.08.117
BindingDB Entry DOI: 10.7270/Q2P84C9P |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1 (ACC1)
(Homo sapiens (Human)) | BDBM50355918
(CHEMBL1910388)Show SMILES CCN(CC)C(=O)c1cccc(c1)N1CCN(CC1)C(=O)c1c2ccccc2cc2ccccc12 Show InChI InChI=1S/C30H31N3O2/c1-3-31(4-2)29(34)24-12-9-13-25(21-24)32-16-18-33(19-17-32)30(35)28-26-14-7-5-10-22(26)20-23-11-6-8-15-27(23)28/h5-15,20-21H,3-4,16-19H2,1-2H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Takeda Pharmaceutical Company, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of human ACC1 |
Bioorg Med Chem Lett 21: 6314-8 (2011)
Article DOI: 10.1016/j.bmcl.2011.08.117
BindingDB Entry DOI: 10.7270/Q2P84C9P |
More data for this
Ligand-Target Pair | |
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