Molecule Details
InChIKeyRPSYWEPJQQLLJN-UHFFFAOYSA-N
Compound Name3-(4-Phenylethynylbenzoyl)nonanoic acid
Canonical SMILESCCCCCCC(CC(=O)O)C(=O)c1ccc(C#Cc2ccccc2)cc1
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL6.35
SourceChEMBL;BindingDB;TTD_MultiTarget
2D Structure
2D structure
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P39900 MMP12 Homo sapiens Human PF00045 PF00413 PF01471 6.3 IC50 ChEMBL;BindingDB
P08253 MMP2 Homo sapiens Human PF00040 PF00045 PF00413 Clinical TTD_MultiTarget TTD_MultiTarget