Molecule Details
InChIKeyPTUCPHGSAFOJAU-HHIKFEJTSA-N
Compound Name(4R)-5-amino-4-[[(2S)-2-[[2-[[(4-bromophenyl)-hydroxyphosphoryl]methyl]-3-[3-[4-(3-chlorophenyl)phenyl]-1,2-oxazol-5-yl]propanoyl]amino]-4-carboxybutanoyl]amino]-5-oxopentanoic acid
Canonical SMILESNC(=O)[C@@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)C(Cc1cc(-c2ccc(-c3cccc(Cl)c3)cc2)no1)CP(=O)(O)c1ccc(Br)cc1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)9
Pfam Stratification Homologous
Avg pChEMBL7.21
SourceBindingDB
2D Structure
2D structure
Activity Profile
Target Activities (9)
Target Gene Organism Category Pfam pChEMBL Type Source
P39900 MMP12 Homo sapiens Human PF00045 PF00413 PF01471 9.7 Ki BindingDB
P09238 MMP10 Homo sapiens Human PF00045 PF00413 PF01471 8.1 Ki BindingDB
P08254 MMP3 Homo sapiens Human PF00045 PF00413 PF01471 7.4 Ki BindingDB
P45452 MMP13 Homo sapiens Human PF00045 PF00413 PF01471 7.3 Ki BindingDB
P50281 MMP14 Homo sapiens Human PF11857 PF00045 PF00413 PF01471 6.8 Ki BindingDB
P08253 MMP2 Homo sapiens Human PF00040 PF00045 PF00413 6.7 Ki BindingDB
P22894 MMP8 Homo sapiens Human PF00045 PF00413 PF01471 6.6 Ki BindingDB
P09237 MMP7 Homo sapiens Human PF00413 PF01471 6.2 Ki BindingDB
P14780 MMP9 Homo sapiens Human PF00040 PF00045 PF00413 6.1 Ki BindingDB