Molecule Details
InChIKeyUXSRDCKIZSWGGE-CUZNLEPHSA-N
Canonical SMILES[C]S[C][C][C@H]([N]C(=O)[C@H]([C][C]([C])[C])[N]C(=O)[C][N]C(=O)[C@H]([C]c1ccccc1)[N]C(=O)[C@H]([C]c1ccccc1)[N]C(=O)[C@H]([C][C]C([N])=O)[N]C(=O)[C@H]([C][C]C([N])=O)[N]C(=O)[C@@H]1[C][C][C]N1C(=O)[C@H]([C][C][C][C][N])[N]C(=O)[C@@H]1[C][C][C]N1C(=O)[C@@H]([N])[C][C][C]N=C([N])[N])C([N])=O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)4
Pfam Stratification Cross-Family
Avg pChEMBL8.23
SourceBindingDB
2D Structure
2D structure
Activity Profile
Target Activities (4)
Target Gene Organism Category Pfam pChEMBL Type Source
P20366 TAC1 Homo sapiens Human PF02202 10.0 Ki BindingDB
P25103 TACR1 Homo sapiens Human PF00001 9.1 IC50 BindingDB
P29371 TACR3 Homo sapiens Human PF00001 6.9 IC50 BindingDB
P21452 TACR2 Homo sapiens Human PF00001 6.9 Ki BindingDB