Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 5/20 | 0.71 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.71 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.71 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.58 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.57 |
| ▸ | DPP4 | P27487 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | DCPS | Q96C86 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | PPARG | P37231 | 1/20 | 0.51 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.51 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.51 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.51 |
| ▸ | KDM1A | O60341 | 1/20 | 0.51 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL14529287 | 0.87 | CYP1A1 (0.77) | CYP1A1CYP1A2CYP1B1ABCG2ADORA2A | |
| SCHEMBL1395347 | 0.87 | CYP1A1 (0.77) | CYP1A1CYP1A2CYP1B1ABCG2ADORA2A | |
| SCHEMBL29593101 | 0.87 | CYP1A1 (0.77) | CYP1A1CYP1A2CYP1B1ABCG2ADORA2A | |
| SCHEMBL12443214 | 0.86 | CYP1A2 (0.75) | CYP1A1CYP1A2CYP1B1ABCG2ADORA2A | |
| Hydrochloric Acid SCHEMBL29281621 | 0.85 | CYP1A1 (0.77) | CYP1A1CYP1A2CYP1B1ABCG2ADORA2A | |
| SCHEMBL28773619 | 0.83 | CYP1A1 (0.71) | CYP1A1CYP1A2CYP1B1ABCG2DPP4 | |
| SCHEMBL28196630 | 0.83 | CYP1A1 (0.97) | CYP1A1CYP1A2CYP1B1ABCG2ADORA2A | |
| SCHEMBL30843880 | 0.81 | CYP1A1 (0.68) | CYP1A1CYP1A2CYP1B1MEN1KMT2A | |
| SCHEMBL11861155 | 0.81 | CYP1A1 (0.68) | CYP1A1CYP1A2CYP1B1MEN1KMT2A | |
| SCHEMBL31061268 | 0.80 | CYP1A1 (0.73) | CYP1A1CYP1A2CYP1B1ABCG2MEN1 |
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-112334466-B | Compounds of formula (I) | CTXT私人有限公司 | 2025-05-30 | — | — | CN | disclosed |
| CN-107652275-A | Quinazoline derivant and its production and use | 沈阳工业大学 | 2018-02-02 | — | — | CN | disclosed |