Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 12/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PDE5A | O76074 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | GUSB | P08236 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 2/20 | 0.37 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL27057151 | 0.86 | TRPV1 (0.52) | TRPV1KDM4ENPC1USP2ALDH1A1 | |
| SCHEMBL20327078 | 0.78 | KDM4E (0.56) | TRPV1KDM4ENPC1USP2ALDH1A1 | |
| SCHEMBL29059499 | 0.76 | TRPV1 (0.42) | TRPV1KDM4ENPC1USP2ALDH1A1 | |
| SCHEMBL29059502 | 0.76 | TRPV1 (0.42) | TRPV1KDM4ENPC1USP2ALDH1A1 | |
| SCHEMBL29059635 | 0.74 | TRPV1 (0.42) | TRPV1KDM4ENPC1USP2ALDH1A1 | |
| SCHEMBL17193012 | 0.74 | KDM4E (0.62) | TRPV1KDM4ENPC1USP2ALDH1A1 | |
| SCHEMBL27041207 | 0.73 | MEN1 (0.47) | TRPV1KDM4EUSP2ALDH1A1GAA | |
| SCHEMBL27041249 | 0.72 | KDM4E (0.56) | TRPV1KDM4ENPC1USP2ALDH1A1 | |
| SCHEMBL24625176 | 0.71 | TRPV1 (0.53) | TRPV1KDM4ENPC1USP2ALDH1A1 | |
| SCHEMBL27389640 | 0.69 | KDM4E (0.55) | TRPV1KDM4ENPC1USP2ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |