Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.48 |
| ▸ | BTK | Q06187 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | CCR1 | P32246 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1202061 | 1.00 | CYP2A6 (0.48) | CYP2A6CYP1A2PDPK1BTKALDH1A1 | |
| SCHEMBL28318632 | 0.98 | CYP2A6 (0.47) | CYP2A6CYP1A2PDPK1BTKALDH1A1 | |
| SCHEMBL8150996 | 0.78 | CYP1A2 (0.48) | CYP2A6CYP1A2PDPK1BTKNPC1 | |
| SCHEMBL2338713 | 0.78 | CYP1A2 (0.48) | CYP2A6CYP1A2PDPK1BTKALDH1A1 | |
| SCHEMBL2013110 | 0.78 | HASPIN (0.44) | CYP2A6ALDH1A1CCR1KDM4E | |
| SCHEMBL2007563 | 0.78 | HASPIN (0.44) | CYP2A6ALDH1A1CCR1 | |
| SCHEMBL13754895 | 0.77 | CYP1A2 (0.40) | CYP2A6CYP1A2PDPK1BTKALDH1A1 | |
| SCHEMBL1564356 | 0.77 | CYP1A2 (0.40) | CYP2A6CYP1A2PDPK1BTKALDH1A1 | |
| SCHEMBL2013055 | 0.76 | NPC1 (0.50) | CYP2A6CYP1A2ALDH1A1NPC1RAB9A | |
| SCHEMBL2008158 | 0.76 | ALDH1A1 (0.49) | CYP2A6CYP1A2ALDH1A1NPC1RAB9A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118955375-A | Tetraphenyl ethylene-isoquinoline compound and preparation method and application thereof | 五邑大学 | 2024-11-15 | — | — | CN | claimed |
| CN-118852107-A | Ultra-high temperature corrosion inhibitor | 广汉市华星新技术开发研究所（普通合伙） | 2024-10-29 | — | — | CN | claimed |
| EP-4547658-A1 | WEE1 DEGRADING COMPOUNDS AND USES THEREOF | Bristol-Myers Squibb Company (US) | 2025-05-07 | — | — | EP | disclosed |
| CN-118852107-A | Ultra-high temperature corrosion inhibitor | 广汉市华星新技术开发研究所（普通合伙） | 2024-10-29 | — | — | CN | disclosed |
| WO-2024006881-A1 | WEE1 DEGRADING COMPOUNDS AND USES THEREOF | BRISTOL-MYERS SQUIBB COMPANY (US) | 2024-01-04 | — | — | WO | disclosed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |