Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 17/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | PARG | Q86W56 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29059499 | 1.00 | TRPV1 (0.42) | TRPV1KDM4ENPC1USP2ALDH1A1 | |
| SCHEMBL29059635 | 0.79 | TRPV1 (0.42) | TRPV1KDM4ENPC1USP2ALDH1A1 | |
| SCHEMBL29789417 | 0.76 | TRPV1 (0.49) | TRPV1KDM4ENPC1USP2ALDH1A1 | |
| SCHEMBL29789457 | 0.71 | CA1 (0.42) | ALDH1A1HPGDLMNA | |
| SCHEMBL2217561 | 0.68 | ALDH1A1 (0.40) | KDM4EALDH1A1GAAHPGDSMN1; SMN2 | |
| SCHEMBL14780291 | 0.68 | CA9 (0.41) | ALDH1A1GAALMNA | |
| SCHEMBL28492758 | 0.68 | ALDH1A1 (0.41) | ALDH1A1GAAMAPTHPGDLMNA | |
| SCHEMBL20327078 | 0.67 | KDM4E (0.56) | TRPV1KDM4ENPC1USP2ALDH1A1 | |
| SCHEMBL9318105 | 0.65 | PLA2G2C (0.46) | KDM4EALDH1A1GAAHPGDSMN1; SMN2 | |
| SCHEMBL14590755 | 0.65 | PLA2G2C (0.46) | KDM4EALDH1A1GAAHPGDSMN1; SMN2 |
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-116249529-A | Quinazoline derivative and application thereof in medicine | 成都百裕制药股份有限公司 | 2023-06-09 | — | — | CN | disclosed |
| WO-2022143533-A1 | QUINAZOLINE DERIVATIVE AND USE THEREOF IN MEDICINE | 成都百裕制药股份有限公司 | 2022-07-07 | — | — | WO | disclosed |