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Assay Detail

CHEMBL1026932

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

Binding
Inhibition of urokinase
ChEMBL ↗
75
Total Activities
75
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Intermediate

Target

Urokinase-type plasminogen activator (CHEMBL3286) ↗
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Large-scale application of high-throughput molecular mechanics with Poisson-Boltzmann surface area for routine physics-based scoring of protein-ligand complexes.
Brown SP, Muchmore SW.
J Med Chem (2009) 52 : 3159 -3165
PubMed 19385614 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 75 6.17 9.20

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL104166 — — 1 9.20
CHEMBL562412 — — 1 8.80
CHEMBL182959 — — 1 8.30
CHEMBL108447 — — 1 8.20
CHEMBL111567 — — 1 7.80
CHEMBL442201 — — 1 7.60
CHEMBL111575 — — 1 7.60
CHEMBL103043 — — 1 7.50
CHEMBL560416 — — 1 7.50
CHEMBL555026 — — 1 7.40
CHEMBL324168 — — 1 7.40
CHEMBL109367 — — 1 7.30
CHEMBL560493 — — 1 7.30
CHEMBL185515 — — 1 7.30
CHEMBL111471 — — 1 7.20
CHEMBL561413 — — 1 7.20
CHEMBL60088 — — 1 7.10
CHEMBL105395 — — 1 7.00
CHEMBL549807 — — 1 7.00
CHEMBL179941 — — 1 6.90
CHEMBL549396 — — 1 6.90
CHEMBL550621 — — 1 6.90
CHEMBL558669 — — 1 6.90
CHEMBL554141 — — 1 6.80
CHEMBL570081 — — 1 6.60
CHEMBL552433 — — 1 6.60
CHEMBL565151 — — 1 6.60
CHEMBL552030 — — 1 6.50
CHEMBL572345 — — 1 6.40
CHEMBL550138 — — 1 6.40

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL104166 — Ki = 0.631 nM 9.20
CHEMBL562412 — Ki = 1.585 nM 8.80
CHEMBL182959 — Ki = 5.012 nM 8.30
CHEMBL108447 — Ki = 6.31 nM 8.20
CHEMBL111567 — Ki = 15.85 nM 7.80
CHEMBL442201 — Ki = 25.12 nM 7.60
CHEMBL111575 — Ki = 25.12 nM 7.60
CHEMBL103043 — Ki = 31.62 nM 7.50
CHEMBL560416 — Ki = 31.62 nM 7.50
CHEMBL555026 — Ki = 39.81 nM 7.40
CHEMBL324168 — Ki = 39.81 nM 7.40
CHEMBL109367 — Ki = 50.12 nM 7.30
CHEMBL560493 — Ki = 50.12 nM 7.30
CHEMBL185515 — Ki = 50.12 nM 7.30
CHEMBL561413 — Ki = 63.1 nM 7.20
CHEMBL111471 — Ki = 63.1 nM 7.20
CHEMBL60088 — Ki = 79.43 nM 7.10
CHEMBL105395 — Ki = 100.0 nM 7.00
CHEMBL549807 — Ki = 100.0 nM 7.00
CHEMBL179941 — Ki = 125.89 nM 6.90
CHEMBL549396 — Ki = 125.89 nM 6.90
CHEMBL550621 — Ki = 125.89 nM 6.90
CHEMBL558669 — Ki = 125.89 nM 6.90
CHEMBL554141 — Ki = 158.49 nM 6.80
CHEMBL565151 — Ki = 251.19 nM 6.60
CHEMBL552433 — Ki = 251.19 nM 6.60
CHEMBL570081 — Ki = 251.19 nM 6.60
CHEMBL552030 — Ki = 316.23 nM 6.50
CHEMBL572345 — Ki = 398.11 nM 6.40
CHEMBL550138 — Ki = 398.11 nM 6.40
CHEMBL559562 — Ki = 398.11 nM 6.40
CHEMBL551628 — Ki = 398.11 nM 6.40
CHEMBL319264 — Ki = 501.19 nM 6.30
CHEMBL104937 — Ki = 630.96 nM 6.20
CHEMBL556663 — Ki = 630.96 nM 6.20
CHEMBL541262 — Ki = 630.96 nM 6.20
CHEMBL540173 — Ki = 630.96 nM 6.20
CHEMBL563776 — Ki = 630.96 nM 6.20
CHEMBL321944 — Ki = 630.96 nM 6.20
CHEMBL551227 — Ki = 794.33 nM 6.10
CHEMBL559895 — Ki = 794.33 nM 6.10
CHEMBL558959 — Ki = 1000.0 nM 6.00
CHEMBL426433 — Ki = 1258.93 nM 5.90
CHEMBL550620 — Ki = 1258.93 nM 5.90
CHEMBL182372 — Ki = 1258.93 nM 5.90
CHEMBL538181 — Ki = 1584.89 nM 5.80
CHEMBL562212 — Ki = 1584.89 nM 5.80
CHEMBL559897 — Ki = 1995.26 nM 5.70
CHEMBL418805 — Ki = 1995.26 nM 5.70
CHEMBL117368 — Ki = 2511.89 nM 5.60