Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | FABP7 | O15540 | 1/20 | 0.47 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL27724950 | 0.95 | ALDH1A1 (0.54) | ALDH1A1TSHRGAASMN1; SMN2NPC1 | |
| SCHEMBL3664444 | 0.87 | TSHR (0.58) | ALDH1A1TSHRGAASMN1; SMN2NPC1 | |
| SCHEMBL6535407 | 0.87 | TSHR (0.47) | ALDH1A1TSHRGAASMN1; SMN2NPC1 | |
| SCHEMBL8692031 | 0.84 | ALDH1A1 (0.53) | ALDH1A1TSHRGAASMN1; SMN2NPC1 | |
| SCHEMBL2703515 | 0.83 | FABP7 (0.55) | ALDH1A1TSHRGAASMN1; SMN2NPC1 | |
| SCHEMBL6666657 | 0.83 | FABP7 (0.58) | ALDH1A1TSHRGAASMN1; SMN2NPC1 | |
| SCHEMBL10917021 | 0.83 | FABP7 (0.58) | ALDH1A1TSHRGAASMN1; SMN2NPC1 | |
| SCHEMBL280126 | 0.83 | FABP7 (0.58) | ALDH1A1TSHRGAASMN1; SMN2NPC1 | |
| SCHEMBL434313 | 0.83 | HTR2C (0.52) | ALDH1A1TSHRGAASMN1; SMN2NPC1 | |
| SCHEMBL31518977 | 0.82 | FABP7 (0.54) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112262129-B | Triazacyclododecanesulfonamide (\"TCD\") based protein secretion inhibitors | 科智生命科学公司 | 2024-05-14 | — | — | CN | disclosed |
| CN-112262129-A | Triazacyclododecane sulfonamide (\"TCD\") based protein secretion inhibitors | 科智生命科学公司 | 2021-01-22 | — | — | CN | disclosed |
| CN-101605761-A | Pyridine derivative or pyrimidine derivative exhibiting excellent cell growth inhibitory effect and antitumor effect on HGFR gene-amplified cell line | EISAI R&D MAN CO LTD (JP) | 2009-12-16 | — | — | CN | disclosed |
| CN-101198590-A | Novel pyridine derivative and pyrimidine derivative (3) | EISAI R&D MAN CO LTD (JP) | 2008-06-11 | — | — | CN | disclosed |