Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | MC4R | P32245 | 1/20 | 0.44 |
| ▸ | MC5R | P33032 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL314040 | 1.00 | CYP1A2 (0.56) | CYP1A2CYP2A6SIGMAR1TDP1HRH3 | |
| SCHEMBL19116113 | 0.93 | TDP1 (0.50) | CYP1A2CYP2A6SIGMAR1TDP1HRH3 | |
| SCHEMBL27938396 | 0.91 | TDP1 (0.48) | CYP1A2CYP2A6SIGMAR1TDP1HRH3 | |
| Acetic Acid SCHEMBL27771808 | 0.87 | CYP1A2 (0.58) | CYP1A2CYP2A6SIGMAR1TDP1HDAC1 | |
| SCHEMBL80282 | 0.87 | SIGMAR1 (0.59) | CYP1A2CYP2A6SIGMAR1HRH3HDAC1 | |
| SCHEMBL6240981 | 0.85 | CYP1A2 (0.65) | CYP1A2CYP2A6SIGMAR1HRH3SLC6A4 | |
| SCHEMBL29560700 | 0.85 | CYP1A2 (0.65) | CYP1A2CYP2A6SIGMAR1HRH3SLC6A4 | |
| SCHEMBL9129308 | 0.85 | SIGMAR1 (0.58) | CYP1A2CYP2A6SIGMAR1HRH3HDAC1 | |
| Benzaldehyde SCHEMBL27720726 | 0.84 | RAB9A (0.55) | CYP1A2CYP2A6SIGMAR1TDP1HRH3 | |
| SCHEMBL7621730 | 0.84 | SIGMAR1 (0.56) | CYP1A2CYP2A6SIGMAR1HRH3HDAC1 |
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-119775194-A | Two-dimensional electrocatalytic hydrogen evolution material constructed based on cation-pi action, preparation method and application | 西北工业大学 | 2025-04-08 | — | — | CN | claimed |
| CN-112771684-B | Ink composition for manufacturing organic semiconductor device | 株式会社大赛璐 | 2024-07-12 | — | — | CN | claimed |
| CN-119775194-A | Two-dimensional electrocatalytic hydrogen evolution material constructed based on cation-pi action, preparation method and application | 西北工业大学 | 2025-04-08 | — | — | CN | disclosed |
| CN-118652443-A | 5FBVI-3B-CB [8] supramolecular cross-linking agent, multi-arm supramolecular hydrogel, preparation method and application thereof | 东莞理工学院 | 2024-09-17 | — | — | CN | disclosed |