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TargetCytochrome P450 11B2, mitochondrial
LigandBDBM8891
Substrate/CompetitorBDBM8582
Meas. Tech.CYP11B Assay
Ki 1.3±n/a nM
IC50 2±n/a nM
Citation Voets, MAntes, IScherer, CMuller-Vieira, UBiemel, KMarchais-Oberwinkler, SHartmann, RW Synthesis and evaluation of heteroaryl-substituted dihydronaphthalenes and indenes: potent and selective inhibitors of aldosterone synthase (CYP11B2) for the treatment of congestive heart failure and myocardial fibrosis. Pharmacol Rev49:2222-31 (2006) [PubMed]  Article
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Cytochrome P450 11B2, mitochondrial
Name:Cytochrome P450 11B2, mitochondrial
Synonyms:Aldosterone Synthase (CYP11B2) | Aldosterone synthase | Aldosterone-synthesizing enzyme | CYPXIB2 | Cytochrome P450 11B2 | Cytochrome P450 11B2 (CYP11B2) | P-450Aldo | P-450C18 | Steroid 18-hydroxylase
Type:Enzyme
Mol. Mass.:57582.15
Organism:Homo sapiens (human)
Description:n/a
Residue:503
Sequence:
MALRAKAEVCVAAPWLSLQRARALGTRAARAPRTVLPFEAMPQHPGNRWLRLLQIWREQG
YEHLHLEMHQTFQELGPIFRYNLGGPRMVCVMLPEDVEKLQQVDSLHPCRMILEPWVAYR
QHRGHKCGVFLLNGPEWRFNRLRLNPDVLSPKAVQRFLPMVDAVARDFSQALKKKVLQNA
RGSLTLDVQPSIFHYTIEASNLALFGERLGLVGHSPSSASLNFLHALEVMFKSTVQLMFM
PRSLSRWISPKVWKEHFEAWDCIFQYGDNCIQKIYQELAFNRPQHYTGIVAELLLKAELS
LEAIKANSMELTAGSVDTTAFPLLMTLFELARNPDVQQILRQESLAAAASISEHPQKATT
ELPLLRAALKETLRLYPVGLFLERVVSSDLVLQNYHIPAGTLVQVFLYSLGRNAALFPRP
ERYNPQRWLDIRGSGRNFHHVPFGFGMRQCLGRRLAEAEMLLLLHHVLKHFLVETLTQED
IKMVYSFILRPGTSPLLTFRAIN
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BDBM8891
NameBDBM8891
Synonyms:3-(6-Methoxy-3,4-dihydronaphthalen-2-yl)pyridine | CHEMBL206351 | Dihydronaphthalene 4 | US9271963, 35
TypeSmall organic molecule
Emp. Form.C16H15NO
Mol. Mass.237.2964
SMILESCOc1ccc2C=C(CCc2c1)c1cccnc1 |c:6|
Structure
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BDBM8582
NameBDBM8582
Synonyms:(1S,2R,10S,11S,14S,15S)-14-(2-hydroxyacetyl)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-5-one | 11-deoxycorticosterone | 21-hydroxypregn-4-ene-3,20-dione | DOC | [4-14C]-11-deoxycorticosterone | deoxycorticosterone
TypeSmall organic molecule
Emp. Form.C21H30O3
Mol. Mass.330.4611
SMILES[H][C@@]12CC[C@H](C(=O)CO)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C |r,t:21|
Structure
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