Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.57 |
| ▸ | CA3 | P07451 | 1/20 | 0.57 |
| ▸ | CA4 | P22748 | 1/20 | 0.57 |
| ▸ | CA6 | P23280 | 1/20 | 0.57 |
| ▸ | CA5A | P35218 | 1/20 | 0.57 |
| ▸ | CA7 | P43166 | 1/20 | 0.57 |
| ▸ | CA9 | Q16790 | 1/20 | 0.57 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.57 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | IDO1 | P14902 | 2/20 | 0.48 |
| ▸ | FERMT2 | Q96AC1 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10994002 | 0.80 | L3MBTL1 (0.43) | CA12CA3CA4CA6CA5A | |
| SCHEMBL5546737 | 0.80 | L3MBTL1 (0.43) | CA12CA3CA4CA6CA5A | |
| SCHEMBL4163019 | 0.80 | RAB9A (0.47) | CA12CA3CA4CA6CA5A | |
| SCHEMBL4629056 | 0.80 | RAB9A (0.51) | ALDH1A1TSHRRECQLHSD17B10L3MBTL1 | |
| SCHEMBL6233644 | 0.80 | PSIP1 (0.50) | ALDH1A1IDO1L3MBTL1NPC1RAB9A | |
| SCHEMBL8306026 | 0.77 | CA12 (0.57) | CA12CA3CA4CA6CA5A | |
| SCHEMBL4158643 | 0.77 | SMN1; SMN2 (0.44) | ALDH1A1L3MBTL1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL3910980 | 0.77 | L3MBTL1 (0.59) | ALDH1A1TSHRIDO1L3MBTL1NPC1 | |
| SCHEMBL8518737 | 0.76 | CA12 (0.55) | CA12CA3CA4CA6CA5A | |
| SCHEMBL1471292 | 0.76 | IDO1 (0.61) | CA12CA3CA4CA6CA5A |
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 |
|---|---|---|---|---|---|---|---|
| EP-4169919-A1 | PYRAZOLO[3,4-D]PYRIMIDINE-3-KETONE DERIVATIVE AS WEE-1 INHIBITOR | Wigen Biomedicine Technology (Shanghai) Co., Ltd. (CN) | 2023-04-26 | — | — | EP | disclosed |