Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | JUN | P05412 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | TNFSF11 | O14788 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | VCP | P55072 | 1/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
| ▸ | GPX4 | P36969 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8779376 | 0.94 | ALDH1A1 (0.41) | NR3C1TSHRALDH1A1HPGDNPC1 | |
| SCHEMBL8779375 | 0.82 | TOP1 (0.37) | ALDH1A1HPGDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL171836 | 0.80 | TSHR (0.64) | NR3C1TSHRACHEALDH1A1JUN | |
| SCHEMBL8779346 | 0.79 | LMNA (0.57) | ALDH1A1NPC1RAB9ASMN1; SMN2PKM | |
| SCHEMBL8779305 | 0.78 | LMNA (0.61) | ACHEALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL8350024 | 0.72 | TSHR (0.60) | NR3C1TSHRACHEALDH1A1JUN | |
| P-Xylene SCHEMBL8779430 | 0.72 | SMN1; SMN2 (0.57) | ACHEALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL8779317 | 0.71 | NPC1 (0.58) | TSHRALDH1A1HPGDPTGS1NPC1 | |
| SCHEMBL8779394 | 0.70 | TRPA1 (0.52) | ALDH1A1HPGDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1144609 | 0.69 | TSHR (0.62) | NR3C1TSHRALDH1A1JUNNFKB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0579129-B1 | Thiadiazole derivatives for the treatment of depressive states | CT LAB FARM SRL (IT) | 1997-03-05 | — | — | EP | claimed |