Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | SLC1A5 | Q15758 | 14/20 | 0.48 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.47 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.47 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.44 |
| ▸ | CTSC | P53634 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27125658 | 1.00 | CYP2C19 (0.49) | CYP2C19SLC1A5SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL27133166 | 0.83 | LTA4H (0.47) | SLC1A5ALDH1A1 | |
| SCHEMBL26987838 | 0.83 | LTA4H (0.47) | SLC1A5ALDH1A1 | |
| SCHEMBL7275819 | 0.83 | CYP2C19 (0.56) | CYP2C19SLC1A3SLC1A2SLC1A1POLB | |
| SCHEMBL9584558 | 0.83 | CYP2C19 (0.56) | CYP2C19SLC1A3SLC1A2SLC1A1POLB | |
| SCHEMBL43292 | 0.76 | CYP2C19 (0.70) | CYP2C19SLC1A3SLC1A2SLC1A1POLB | |
| SCHEMBL43293 | 0.76 | CYP2C19 (0.70) | CYP2C19SLC1A3SLC1A2SLC1A1POLB | |
| SCHEMBL288244 | 0.76 | CYP2C19 (0.70) | CYP2C19SLC1A3SLC1A2SLC1A1POLB | |
| SCHEMBL26987958 | 0.75 | HDAC3 (0.55) | CYP2C19SLC1A5 | |
| SCHEMBL27125342 | 0.75 | HDAC3 (0.55) | CYP2C19SLC1A5 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024010732-A1 | SMALL MOLECULE INHIBITORS OF GLUTAMINE TRANSPORTER ASCT2 AND METHODS OF USE THEREOF | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2024-01-11 | — | — | WO | disclosed |