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Assay Detail

CHEMBL3583831

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of human CYP11B2 expressed in V79 cells incubated for 1 hr before 11-deoxycorticosterone substrate addition by HTRF-based assay
37
Total Activities
37
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type V79
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Cytochrome P450 11B2, mitochondrial (CHEMBL2722)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of Benzimidazole CYP11B2 Inhibitors with in Vivo Activity in Rhesus Monkeys.
Hoyt SB, Park MK, London C, Xiong Y, Tata J, Bennett DJ, Cooke A, Cai J, Carswell E, Robinson J, MacLean J, Brown L, Belshaw S, Clarkson TR, Liu K, Liang GB, Struthers M, Cully D, Wisniewski T, Ren N, Bopp C, Sok A, Cai TQ, Stribling S, Pai LY, Ma X, Metzger J, Verras A, McMasters D, Chen Q, Tung E, Tang W, Salituro G, Buist N, Kuethe J, Rivera N, Clemas J, Zhou G, Gibson J, Maxwell CA, Lassman M, McLaughlin T, Castro-Perez J, Szeto D, Forrest G, Hajdu R, Rosenbach M, Ali A.
ACS Med Chem Lett (2015) 6 : 573 -578
PubMed 26005536 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 37 8.07 9.70

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3582482 1 9.70
CHEMBL3582477 1 9.52
CHEMBL3582474 1 9.40
CHEMBL3582470 1 9.40
CHEMBL3582481 1 9.30
CHEMBL3582483 1 9.22
CHEMBL3582471 1 9.22
CHEMBL3582475 1 9.10
CHEMBL3582476 1 9.00
CHEMBL3582467 1 8.92
CHEMBL3582469 1 8.68
CHEMBL3582465 1 8.66
CHEMBL3582478 MSD-CYP11B2 1 8.64
CHEMBL3582451 1 8.40
CHEMBL3582472 1 8.33
CHEMBL3582480 1 8.09
CHEMBL3582479 1 7.99
CHEMBL3582447 1 7.92
CHEMBL3582452 1 7.80
CHEMBL3582473 1 7.65
CHEMBL3582468 1 7.62
CHEMBL3582459 1 7.55
CHEMBL3582449 1 7.46
CHEMBL3582457 1 7.31
CHEMBL3582460 1 6.97
CHEMBL3582450 1 6.86
CHEMBL3582458 1 6.66
CHEMBL3582466 1 6.59
CHEMBL3582455 1 6.25
CHEMBL3582456 1 6.22

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3582482 IC50 = 0.2 nM 9.70
CHEMBL3582477 IC50 = 0.3 nM 9.52
CHEMBL3582470 IC50 = 0.4 nM 9.40
CHEMBL3582474 IC50 = 0.4 nM 9.40
CHEMBL3582481 IC50 = 0.5 nM 9.30
CHEMBL3582483 IC50 = 0.6 nM 9.22
CHEMBL3582471 IC50 = 0.6 nM 9.22
CHEMBL3582475 IC50 = 0.8 nM 9.10
CHEMBL3582476 IC50 = 1.0 nM 9.00
CHEMBL3582467 IC50 = 1.2 nM 8.92
CHEMBL3582469 IC50 = 2.1 nM 8.68
CHEMBL3582465 IC50 = 2.2 nM 8.66
CHEMBL3582478 MSD-CYP11B2 IC50 = 2.3 nM 8.64
CHEMBL3582451 IC50 = 4.0 nM 8.40
CHEMBL3582472 IC50 = 4.7 nM 8.33
CHEMBL3582480 IC50 = 8.1 nM 8.09
CHEMBL3582479 IC50 = 10.2 nM 7.99
CHEMBL3582447 IC50 = 12.0 nM 7.92
CHEMBL3582452 IC50 = 16.0 nM 7.80
CHEMBL3582473 IC50 = 22.3 nM 7.65
CHEMBL3582468 IC50 = 24.0 nM 7.62
CHEMBL3582459 IC50 = 28.0 nM 7.55
CHEMBL3582449 IC50 = 35.0 nM 7.46
CHEMBL3582457 IC50 = 49.0 nM 7.31
CHEMBL3582460 IC50 = 107.0 nM 6.97
CHEMBL3582450 IC50 = 138.0 nM 6.86
CHEMBL3582458 IC50 = 219.0 nM 6.66
CHEMBL3582466 IC50 = 254.0 nM 6.59
CHEMBL3582455 IC50 = 561.0 nM 6.25
CHEMBL3582456 IC50 = 607.0 nM 6.22
CHEMBL3582463 IC50 = 1768.0 nM 5.75
CHEMBL3582454 IC50 > 5000.0 nM -
CHEMBL3582453 IC50 > 5000.0 nM -
CHEMBL3582464 IC50 > 1000.0 nM -
CHEMBL3582461 MSD-CYP11B2-Negative-control IC50 > 10000.0 nM -
CHEMBL3582448 IC50 > 10000.0 nM -
CHEMBL3582462 IC50 > 1000.0 nM -