Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.39 |
| ▸ | GABRP | O00591 | 2/20 | 0.38 |
| ▸ | GABRD | O14764 | 2/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.38 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.38 |
| ▸ | GABRE | P78334 | 2/20 | 0.38 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.38 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.38 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7179689 | 0.85 | ALDH1A1 (0.45) | ALDH1A1TSHRCES2CES1PBRM1 | |
| SCHEMBL9726458 | 0.79 | ALDH1A1 (0.67) | ALDH1A1TSHRCES2CES1PBRM1 | |
| SCHEMBL58731 | 0.75 | ALDH1A1 (0.42) | ALDH1A1TSHRCES2CES1PBRM1 | |
| SCHEMBL7865373 | 0.74 | CA12 (0.50) | NPC1 | |
| SCHEMBL247465 | 0.74 | KMT2A (0.43) | ALDH1A1POLBCYP3A4CYP2C9LMNA | |
| SCHEMBL5164361 | 0.73 | AKR1C3 (0.55) | ALDH1A1POLBCYP2C9GAAMEN1 | |
| SCHEMBL9725353 | 0.72 | TSHR (0.57) | ALDH1A1TSHRCES2CES1PBRM1 | |
| SCHEMBL611462 | 0.72 | MEN1 (0.54) | ALDH1A1CES2CES1RORCCYP1A2 | |
| SCHEMBL7182714 | 0.71 | RORC (0.42) | ALDH1A1TSHRCES2CES1RORC | |
| SCHEMBL7175629 | 0.71 | TSHR (0.39) | ALDH1A1TSHRCES2CES1PBRM1 |
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-0325266-B1 | DENTAL MATTER | THERA Patent GmbH & Co. KG Gesellschaft für industrielle Schutzrechte (DE) | 1993-08-11 | — | — | EP | claimed |