Reaction Details |
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Target | Cytochrome P450 2E1 |
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Ligand | BDBM50183068 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_368940 (CHEMBL869056) |
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IC50 | 14000±n/a nM |
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Citation | Vlahakis, JZ; Kinobe, RT; Bowers, RJ; Brien, JF; Nakatsu, K; Szarek, WA Imidazole-dioxolane compounds as isozyme-selective heme oxygenase inhibitors. J Med Chem49:4437-41 (2006) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Cytochrome P450 2E1 |
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Name: | Cytochrome P450 2E1 |
Synonyms: | 4-nitrophenol 2-hydroxylase | CP2E1_RAT | CYPIIE1 | Cyp2e | Cyp2e-1 | Cyp2e1 |
Type: | Enzyme |
Mol. Mass.: | 56637.32 |
Organism: | Rattus norvegicus (rat) |
Description: | CYP2E1 prepared from rat liver microsomes was used in enzyme assays. |
Residue: | 493 |
Sequence: | MAVLGITIALLVWVATLLVISIWKQIYNSWNLPPGPFPLPILGNIFQLDLKDIPKSFTKL
AKRFGPVFTLHLGSRRIVVLHGYKAVKEVLLNHKNEFSGRGDIPVFQEYKNKGIIFNNGP
TWKDVRRFSLSILRDWGMGKQGNEARIQREAQFLVEELKKTKGQPFDPTFLIGCAPCNVI
ADILFNKRFDYNDKKCLRLMSLFNENFYLLSTPWIQLYNNFADYLRYLPGSHRKIMKNVS
EIKQYTLEKAKEHLQSLDINCARDVTDCLLIEMEKEKHSQEPMYTMENVSVTLADLFFAG
TETTSTTLRYGLLILMKYPEIEEKLHEEIDRVIGPSRVPAVRDRLDMPYMDAVVHEIQRF
INLVPSNLPHEATRDTVFQGYVIPKGTVVIPTLDSLLYDSHEFPDPEKFKPEHFLNENGK
FKYSDYFKAFSAGKRVCVGEGLARMELFLLLSAILQHFNLKSLVDPKDIDLSPVTVGFGS
IPPQFKLCVIPRS
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BDBM50183068 |
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n/a |
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Name | BDBM50183068 |
Synonyms: | 1-((2-(4-chlorophenethyl)-1,3-dithiolan-2-yl)methyl)-1H-imidazole hydrochloride | 2-[2-(4-chlorophenyl)ethyl]-2-[(1H-imidazol-1-yl)methyl]-1,3-dithiolane hydrochloride | CHEMBL537200 |
Type | Small organic molecule |
Emp. Form. | C15H17ClN2S2 |
Mol. Mass. | 324.892 |
SMILES | Clc1ccc(CCC2(Cn3ccnc3)SCCS2)cc1 |
Structure |
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