Molecule Details
InChIKeyAFHGEWVXXQPUJF-JDBYEFRYSA-N
Compound Name(10S,11R,12S,15S,18S)-15-(2-amino-2-oxoethyl)-10,11,23-trihydroxy-18-[[(3S)-3-methyl-2-oxopentanoyl]amino]-9,14,17-trioxo-N-[(Z)-prop-1-enyl]-8,13-diazatetracyclo[18.3.1.02,7.06,10]tetracosa-1(23),2(7),3,5,20(24),21-hexaene-12-carboxamide
Canonical SMILESC/C=C\NC(=O)[C@H]1NC(=O)[C@H](CC(N)=O)CC(=O)[C@@H](NC(=O)C(=O)[C@@H](C)CC)Cc2ccc(O)c(c2)-c2cccc3c2NC(=O)[C@@]3(O)[C@@H]1O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.46
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P28074 PSMB5 Homo sapiens Human PF00227 8.5 IC50 ChEMBL;BindingDB
P20618 PSMB1 Homo sapiens Human PF00227 7.2 IC50 ChEMBL;BindingDB
P49721 PSMB2 Homo sapiens Human PF00227 6.7 IC50 ChEMBL;BindingDB