Molecule Details
InChIKeyWFVHHGNMKJUPFM-SRVKXCTJSA-N
Compound Name4-N-[5-[(1R,2S)-2-fluorocyclopropyl]-1H-pyrazol-3-yl]-2-N-[(1S)-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)ethyl]pyrimidine-2,4-diamine
Canonical SMILESC[C@H](Nc1nccc(Nc2cc([C@H]3C[C@@H]3F)[nH]n2)n1)c1ccc2[nH]ccc2n1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.41
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
Q13153 PAK1 Homo sapiens Human PF00786 PF00069 8.0 Ki ChEMBL;BindingDB
O75914 PAK3 Homo sapiens Human PF00786 PF00069 7.1 IC50 ChEMBL
Q13177 PAK2 Homo sapiens Human PF00786 PF00069 7.1 IC50 ChEMBL