BDBM92497 CHEMBL542051::Omega-imidazolyl octanoic acid
SMILES: OC(=O)CCCCCCCn1ccnc1
InChI Key: InChIKey=OUQGDTNNZRAKIB-UHFFFAOYSA-N
Data: 2 IC50 1 Kd
PDB links: 1 PDB ID matches this monomer.
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 3 hits for monomerid = 92497 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 |
Cytochrome P450 2E1
(Homo sapiens (Human)) | BDBM92497
(CHEMBL542051 | Omega-imidazolyl octanoic acid)Show InChI InChI=1S/C11H18N2O2/c14-11(15)6-4-2-1-3-5-8-13-9-7-12-10-13/h7,9-10H,1-6,8H2,(H,14,15) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| MMDB PDB Article PubMed
| n/a | n/a | n/a | 2.10E+4 | n/a | n/a | n/a | n/a | n/a |
The University of Kansas
| Assay Description Binding assay using CYP2E1. |
J Biol Chem 285: 22282-90 (2010)
Article DOI: 10.1074/jbc.M110.109017 BindingDB Entry DOI: 10.7270/Q2FF3QZH |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Thromboxane A2 Synthase (P450 TxA2)
(Homo sapiens (Human)) | BDBM92497
(CHEMBL542051 | Omega-imidazolyl octanoic acid)Show InChI InChI=1S/C11H18N2O2/c14-11(15)6-4-2-1-3-5-8-13-9-7-12-10-13/h7,9-10H,1-6,8H2,(H,14,15) | KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| PubMed
| n/a | n/a | 32 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibitory activity against Thromboxane synthetase |
J Med Chem 24: 1149-55 (1982)
BindingDB Entry DOI: 10.7270/Q2FT8MMG |
More data for this Ligand-Target Pair | |
Thromboxane A2 Synthase (P450 TxA2)
(Homo sapiens (Human)) | BDBM92497
(CHEMBL542051 | Omega-imidazolyl octanoic acid)Show InChI InChI=1S/C11H18N2O2/c14-11(15)6-4-2-1-3-5-8-13-9-7-12-10-13/h7,9-10H,1-6,8H2,(H,14,15) | KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| PubMed
| n/a | n/a | 32 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibitory activity against human thromboxane synthetase |
J Med Chem 24: 1139-48 (1982)
BindingDB Entry DOI: 10.7270/Q2KK9CB6 |
More data for this Ligand-Target Pair | |