Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 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 | |
|---|---|---|---|---|
| Thiobenzoic Acid SCHEMBL164263 | 0.84 | TDP1 (0.36) | NPC1RAB9AALDH1A1SMN1; SMN2HCAR2 | |
| Thiobenzoic Acid SCHEMBL163805 | 0.79 | ALDH1A1 (0.41) | NPC1RAB9AALDH1A1POLBALOX12 | |
| Thiobenzoic Acid SCHEMBL1524465 | 0.75 | ALDH1A1 (0.43) | NPC1RAB9AALDH1A1POLB | |
| Thiobenzoic Acid SCHEMBL28352009 | 0.73 | ALDH1A1 (0.47) | MRGPRX4NPC1RAB9AALDH1A1POLB | |
| Thiobenzoic Acid SCHEMBL29060728 | 0.71 | ALDH1A1 (0.51) | NPC1RAB9AALDH1A1POLBALOX12 | |
| Thiobenzoic Acid SCHEMBL161426 | 0.71 | CA12 (0.39) | NPC1RAB9AALDH1A1HCAR2 | |
| Thiobenzoic Acid SCHEMBL164093 | 0.70 | ALDH1A1 (0.47) | ALDH1A1HTTHSP90AA1 | |
| Thiobenzoic Acid SCHEMBL15388584 | 0.69 | ALDH1A1 (0.46) | ALDH1A1HTTHSP90AA1 | |
| SCHEMBL30471624 | 0.68 | TDP1 (0.32) | MRGPRX4HTT | |
| SCHEMBL29020501 | 0.68 | TDP1 (0.32) | MRGPRX4HTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-116323785-A | Rubber composition, sulfide, and vulcanized molded article | 电化株式会社 | 2023-06-23 | — | — | CN | disclosed |
| CN-116323784-A | Rubber composition, sulfide, and vulcanized molded article | 电化株式会社 | 2023-06-23 | — | — | CN | disclosed |