Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 2/20 | 0.42 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.40 |
| ▸ | GALR3 | O60755 | 1/20 | 0.38 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 4/20 | 0.38 |
| ▸ | CNR2 | P34972 | 4/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28698711 | 1.00 | HPGD (0.45) | HPGDEGFRABCG2CYP1A2CYP3A4 | |
| SCHEMBL29898303 | 1.00 | HPGD (0.45) | HPGDEGFRABCG2CYP1A2CYP3A4 | |
| SCHEMBL28689155 | 0.88 | HPGD (0.47) | HPGDEGFRABCG2CYP1A2CYP3A4 | |
| SCHEMBL29898273 | 0.88 | HPGD (0.47) | HPGDEGFRABCG2CYP1A2CYP3A4 | |
| SCHEMBL28689152 | 0.82 | EGFR (0.42) | HPGDEGFRABCG2CYP1A2TSHR | |
| SCHEMBL29898291 | 0.82 | EGFR (0.42) | HPGDEGFRABCG2CYP1A2TSHR | |
| SCHEMBL28689151 | 0.82 | EGFR (0.42) | HPGDEGFRABCG2CYP1A2TSHR | |
| SCHEMBL30039562 | 0.81 | CRHR1 (0.37) | HPGDCYP1A2CYP3A4CYP2C19MRGPRX4 | |
| SCHEMBL28765486 | 0.81 | CRHR1 (0.37) | HPGDCYP1A2CYP3A4CYP2C19MRGPRX4 | |
| SCHEMBL28765487 | 0.81 | CRHR1 (0.37) | HPGDCYP1A2CYP3A4CYP2C19MRGPRX4 |
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-113754636-B | Quinazoline-containing aza-ether compounds | 湖南化工研究院有限公司 | 2022-10-04 | — | — | CN | claimed |
| CN-113754636-A | Quinazoline-containing aza-ether compounds | 湖南化工研究院有限公司 | 2021-12-07 | — | — | CN | claimed |