Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 16/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | TDO2 | P48775 | 1/20 | 0.44 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | PNMT | P11086 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29649410 | 0.88 | HTR6 (0.46) | HTR6CYP3A4IDO1TDO2PNMT | |
| SCHEMBL7790505 | 0.86 | CA12 (0.45) | HTR6PGRCA12CA1CA2 | |
| SCHEMBL14009938 | 0.81 | HTR6 (0.66) | HTR6 | |
| SCHEMBL1282130 | 0.81 | HTR6 (0.66) | HTR6 | |
| SCHEMBL3184750 | 0.81 | HTR6 (0.66) | HTR6 | |
| SCHEMBL1003328 | 0.78 | CYP3A4 (0.46) | HTR6CYP3A4IDO1TDO2PNMT | |
| SCHEMBL25081060 | 0.76 | HTR6 (0.49) | HTR6CYP3A4IDO1TDO2PNMT | |
| SCHEMBL7909262 | 0.76 | CA1 (0.47) | HTR6PGRCA12CA1CA2 | |
| SCHEMBL17141459 | 0.76 | SCN5A (0.44) | HTR6CA12CA1CA2CA7 | |
| SCHEMBL17141458 | 0.76 | SCN5A (0.44) | HTR6CA12CA1CA2CA7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3394068-B1 | TDO2 INHIBITORS | GENENTECH INC (US) | 2024-09-11 | — | — | EP | disclosed |
| CN-110072864-B | TDO2 inhibitors | 基因泰克公司 | 2022-05-27 | — | — | CN | disclosed |