Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MGAM | O43451 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SI | P14410 | 1/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | GSK3A | P49840 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 2/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | BRD4 | O60885 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9111764 | 0.83 | TSHR (0.33) | TSHRHSD17B10ALDH1A1KMT2AMAPT | |
| SCHEMBL13413685 | 0.71 | LPO (0.33) | TSHRHSD17B10ALDH1A1HPGD | |
| SCHEMBL19838577 | 0.69 | HTT (0.38) | HSD17B10ALDH1A1KMT2AMAPTHPGD | |
| SCHEMBL9110269 | 0.68 | ALDH1A1 (0.35) | TSHRHSD17B10ALDH1A1KMT2AMAPT | |
| SCHEMBL9112483 | 0.64 | MGAM (0.36) | TSHRHSD17B10ALDH1A1KMT2AMAPT | |
| SCHEMBL6924804 | 0.62 | GSK3A (0.41) | TSHRHSD17B10ALDH1A1KMT2AMGAM | |
| SCHEMBL736634 | 0.61 | GSK3A (0.40) | TSHRHSD17B10ALDH1A1KMT2AMAPT | |
| SCHEMBL31598498 | 0.56 | GSK3A (0.35) | TSHRHSD17B10ALDH1A1KMT2AMAPT | |
| SCHEMBL1649446 | 0.56 | TSHR (0.33) | TSHRCYP2C19 | |
| SCHEMBL6943189 | 0.56 | ALDH1A1 (0.30) | TSHRALDH1A1ALOX15 |
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-1995010505-A1 | FUNCTIONALIZATION OF ACYL PYRIDINIUM SALTS | SYNAPTIC PHARMACEUTICAL CORPORATION (US) | 1995-04-20 | — | — | WO | disclosed |