Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL26697277 | 0.82 | FAAH (0.56) | KMT2AGAAKDM4EBLMALDH1A1 | |
| SCHEMBL9123516 | 0.78 | POLB (0.47) | KMT2AMEN1POLBGAAKDM4E | |
| SCHEMBL11483294 | 0.78 | POLB (0.49) | KMT2AMEN1POLBGAAKDM4E | |
| SCHEMBL11480220 | 0.78 | POLB (0.49) | KMT2AMEN1POLBGAAKDM4E | |
| SCHEMBL27851941 | 0.76 | ESR1 (0.62) | KMT2AMEN1GAASMN1; SMN2HTT | |
| SCHEMBL9124655 | 0.75 | TRPV1 (0.60) | KMT2AMEN1GAAKDM4EBLM | |
| SCHEMBL9127230 | 0.75 | CNR1 (0.50) | KMT2AMEN1ATM | |
| SCHEMBL28556966 | 0.75 | ALDH1A1 (0.59) | KMT2AMEN1POLBGAAKDM4E | |
| SCHEMBL24168968 | 0.75 | ATM (0.54) | KMT2AMEN1POLBGAAKDM4E | |
| SCHEMBL31417771 | 0.75 | FAAH (0.55) | KMT2AMEN1POLBGAAKDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114920703-B | Quinazoline derivative and preparation method and application thereof | 天津济坤医药科技有限公司 | 2024-01-09 | — | — | CN | disclosed |
| WO-2023226323-A1 | QUINAZOLINE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 天津济坤医药科技有限公司 | 2023-11-30 | — | — | WO | disclosed |
| CN-114920703-A | Quinazoline derivative and preparation method and application thereof | 天津济坤医药科技有限公司 | 2022-08-19 | — | — | CN | disclosed |