Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | GCGR | P47871 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | TTK | P33981 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.34 |
| ▸ | SNCA | P37840 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | MKNK1 | Q9BUB5 | 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 | |
|---|---|---|---|---|
| SCHEMBL7278725 | 0.77 | CYP19A1 (0.64) | CYP19A1MAPTELOVL1CYP3A4CYP2D6 | |
| SCHEMBL3824432 | 0.73 | CA12 (0.44) | MAPTCYP2D6KDM4EALDH1A1LMNA | |
| SCHEMBL8027259 | 0.73 | KDM4E (0.38) | MAPTKDM4EALDH1A1SNCAMAPK1 | |
| SCHEMBL1422827 | 0.73 | CYP19A1 (0.62) | CYP19A1MAPTCYP2A6AURKATTK | |
| SCHEMBL6213208 | 0.72 | KDM4E (0.43) | MAPTKDM4EALDH1A1CDK2MAPK1 | |
| SCHEMBL5762848 | 0.72 | TSHR (0.41) | MAPTGCGRMAPK14KDM4EALDH1A1 | |
| SCHEMBL13764327 | 0.70 | CA12 (0.48) | MAPTCYP2D6KDM4EALDH1A1LMNA | |
| SCHEMBL12380456 | 0.69 | ALDH1A1 (0.39) | MAPTCYP2D6KDM4EALDH1A1LMNA | |
| SCHEMBL3260151 | 0.67 | CHRNB2 (0.44) | MAPTCYP2D6KDM4EALDH1A1LMNA | |
| SCHEMBL10517456 | 0.67 | SMN1; SMN2 (0.47) | MAPTKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0200024-B1 | 3-CYANO-PYRIDINES, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL USE | ARZNEIMITTELWERK DRESDEN GmbH (DE) | 1992-07-01 | — | — | EP | disclosed |
| EP-0200024-A2 | 3-Cyano-pyridines, process for their preparation and their pharmaceutical use | ARZNEIMITTELWERK DRESDEN GmbH (DE) | 1986-11-05 | — | — | EP | disclosed |