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Assay Detail

CHEMBL642800

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

ADMET
Inhibition constant as dissociation constant of the noncovalent (STS) enzyme-inhibitor complex
14
Total Activities
14
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

ADMET (CHEMBL612558)
Type ADMET

Publication

2-Substituted 4-(thio)chromenone 6-O-sulfamates: potent inhibitors of human steroid sulfatase.
Nussbaumer P, Lehr P, Billich A.
J Med Chem (2002) 45 : 4310 -4320
PubMed 12213072 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 14 5.81 6.72

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL341736 1 6.72
CHEMBL262050 1 6.68
CHEMBL137479 1 6.66
CHEMBL435988 1 6.30
CHEMBL344037 1 6.14
CHEMBL137392 1 6.05
CHEMBL138488 1 6.00
CHEMBL137289 1 5.96
CHEMBL137513 1 5.92
CHEMBL137692 1 5.77
CHEMBL136663 1 5.73
CHEMBL137227 1 4.62
CHEMBL334696 1 4.50
CHEMBL342715 1 4.27

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL341736 Ki = 190.0 nM 6.72
CHEMBL262050 Ki = 210.0 nM 6.68
CHEMBL137479 Ki = 220.0 nM 6.66
CHEMBL435988 Ki = 500.0 nM 6.30
CHEMBL344037 Ki = 730.0 nM 6.14
CHEMBL137392 Ki = 900.0 nM 6.05
CHEMBL138488 Ki = 1000.0 nM 6.00
CHEMBL137289 Ki = 1100.0 nM 5.96
CHEMBL137513 Ki = 1200.0 nM 5.92
CHEMBL137692 Ki = 1700.0 nM 5.77
CHEMBL136663 Ki = 1860.0 nM 5.73
CHEMBL137227 Ki = 24000.0 nM 4.62
CHEMBL334696 Ki = 32000.0 nM 4.50
CHEMBL342715 Ki = 53700.0 nM 4.27