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Assay Detail

CHEMBL2388034

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

Binding
Inhibition of human recombinant renin using Arg-Glu(EDANS)-Ile-His-Pro-Phe-His-Leu-Val-Ile-His-Thr-Lys (DABCYL)-Arg as substrate incubated for 10 mins prior to substrate addition measured after 90 mins by fluorescence assay
ChEMBL ↗
46
Total Activities
46
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Renin (CHEMBL286) ↗
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Lead optimization of 5-amino-6-(2,2-dimethyl-5-oxo-4-phenylpiperazin-1-yl)-4-hydroxyhexanamides to reduce a cardiac safety issue: discovery of DS-8108b, an orally active renin inhibitor.
Nakamura Y, Fujimoto T, Ogawa Y, Namiki H, Suzuki S, Asano M, Sugita C, Mochizuki A, Miyazaki S, Tamaki K, Nagai Y, Inoue S, Nagayama T, Kato M, Chiba K, Takasuna K, Nishi T.
Bioorg Med Chem (2013) 21 : 3175 -3196
PubMed 23598247 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 46 8.74 9.10

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL2387447 — — 1 9.10
CHEMBL2387557 — — 1 9.05
CHEMBL2387567 — — 1 9.05
CHEMBL2048702 — — 1 9.00
CHEMBL2387558 — — 1 9.00
CHEMBL2387448 — — 1 9.00
CHEMBL2387563 — — 1 9.00
CHEMBL2387446 — — 1 9.00
CHEMBL2387565 — — 1 8.96
CHEMBL2387449 — — 1 8.96
CHEMBL2387568 — — 1 8.96
CHEMBL2387564 — — 1 8.96
CHEMBL2387569 — — 1 8.96
CHEMBL2387566 — — 1 8.89
CHEMBL2387571 — — 1 8.89
CHEMBL2387551 — — 1 8.85
CHEMBL2387444 — — 1 8.85
CHEMBL2387573 — — 1 8.85
CHEMBL2048571 — — 1 8.85
CHEMBL2387544 — — 1 8.85
CHEMBL2387554 — — 1 8.85
CHEMBL2387546 — — 1 8.85
CHEMBL2387552 — — 1 8.80
CHEMBL2387453 — — 1 8.80
CHEMBL2387550 — — 1 8.80
CHEMBL2387575 — — 1 8.80
CHEMBL2387559 — — 1 8.77
CHEMBL2387574 — — 1 8.77
CHEMBL2387452 — — 1 8.77
CHEMBL2387542 — — 1 8.74

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL2387447 — IC50 = 0.8 nM 9.10
CHEMBL2387557 — IC50 = 0.9 nM 9.05
CHEMBL2387567 — IC50 = 0.9 nM 9.05
CHEMBL2048702 — IC50 = 1.0 nM 9.00
CHEMBL2387558 — IC50 = 1.0 nM 9.00
CHEMBL2387448 — IC50 = 1.0 nM 9.00
CHEMBL2387563 — IC50 = 1.0 nM 9.00
CHEMBL2387446 — IC50 = 1.0 nM 9.00
CHEMBL2387569 — IC50 = 1.1 nM 8.96
CHEMBL2387565 — IC50 = 1.1 nM 8.96
CHEMBL2387564 — IC50 = 1.1 nM 8.96
CHEMBL2387568 — IC50 = 1.1 nM 8.96
CHEMBL2387449 — IC50 = 1.1 nM 8.96
CHEMBL2387566 — IC50 = 1.3 nM 8.89
CHEMBL2387571 — IC50 = 1.3 nM 8.89
CHEMBL2387551 — IC50 = 1.4 nM 8.85
CHEMBL2387546 — IC50 = 1.4 nM 8.85
CHEMBL2387554 — IC50 = 1.4 nM 8.85
CHEMBL2387544 — IC50 = 1.4 nM 8.85
CHEMBL2048571 — IC50 = 1.4 nM 8.85
CHEMBL2387573 — IC50 = 1.4 nM 8.85
CHEMBL2387444 — IC50 = 1.4 nM 8.85
CHEMBL2387575 — IC50 = 1.6 nM 8.80
CHEMBL2387453 — IC50 = 1.6 nM 8.80
CHEMBL2387552 — IC50 = 1.6 nM 8.80
CHEMBL2387550 — IC50 = 1.6 nM 8.80
CHEMBL2387559 — IC50 = 1.7 nM 8.77
CHEMBL2387574 — IC50 = 1.7 nM 8.77
CHEMBL2387452 — IC50 = 1.7 nM 8.77
CHEMBL2387542 — IC50 = 1.8 nM 8.74
CHEMBL2387547 — IC50 = 1.8 nM 8.74
CHEMBL2387555 — IC50 = 1.9 nM 8.72
CHEMBL2387572 — IC50 = 1.9 nM 8.72
CHEMBL2387570 — IC50 = 2.0 nM 8.70
CHEMBL2387556 — IC50 = 2.0 nM 8.70
CHEMBL2387545 — IC50 = 2.0 nM 8.70
CHEMBL2387548 — IC50 = 2.1 nM 8.68
CHEMBL2387549 — IC50 = 2.4 nM 8.62
CHEMBL2387451 — IC50 = 2.4 nM 8.62
CHEMBL2387445 — IC50 = 2.9 nM 8.54
CHEMBL2387553 — IC50 = 3.2 nM 8.49
CHEMBL2387562 — IC50 = 3.8 nM 8.42
CHEMBL2387561 — IC50 = 5.6 nM 8.25
CHEMBL2387560 — IC50 = 6.7 nM 8.17
CHEMBL2387543 — IC50 = 16.0 nM 7.80
CHEMBL2387450 — IC50 = 97.0 nM 7.01