Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.33 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.33 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.33 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | PHGDH | O43175 | 1/20 | 0.30 |
| ▸ | MGLL | Q99685 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15295375 | 1.00 | CHRNA3 (0.33) | CHRNA3CARM1PRMT6PRMT1PRMT8 | |
| SCHEMBL22631621 | 1.00 | CHRNA3 (0.33) | CHRNA3CARM1PRMT6PRMT1PRMT8 | |
| SCHEMBL21015726 | 1.00 | CHRNA3 (0.33) | CHRNA3CARM1PRMT6PRMT1PRMT8 | |
| SCHEMBL15295338 | 1.00 | CHRNA3 (0.33) | CHRNA3CARM1PRMT6PRMT1PRMT8 | |
| SCHEMBL25935660 | 0.87 | CYP1A2 (0.37) | CHRNA3CYP1A2 | |
| SCHEMBL22789101 | 0.80 | CHRNA3 (0.33) | CHRNA3CARM1PRMT6PRMT1PRMT8 | |
| SCHEMBL6628623 | 0.80 | PHGDH (0.33) | CHRNA3CARM1PRMT6PRMT1PRMT8 | |
| SCHEMBL18225993 | 0.80 | HTT (0.38) | CHRNA3CARM1PRMT6PRMT1PRMT8 | |
| SCHEMBL17835225 | 0.78 | — | — | |
| SCHEMBL12932567 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023184327-A1 | KINASE INHIBITORS, PREPARATION METHODS AND USES THEREOF | InventisBio Co., Ltd. (CN) | 2023-10-05 | — | — | WO | disclosed |
| EP-3733663-B1 | 1-[6-[[4-(PHENYLAMINO)-6-QUINAZOLINYL]OXY]-3-AZABICYCLO[3.1.1]HEPT-3-YL]-2-PROPEN-1-ONE DERIVATIVES AND RELATED COMPOUNDS AS IRREVERSIBLE INHIBITORS OF PAN-HER TYROSINE KINASE FOR THE TREATMENT OF CANCER | CHENGDU JINRUI FOUND BIOTECH CO LTD (CN) | 2023-05-17 | — | — | EP | disclosed |
| WO-2020108613-A1 | HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF | 江苏豪森药业集团有限公司 | 2020-06-04 | — | — | WO | disclosed |