Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8576432 | 0.87 | ALDH1A1 (0.39) | SLC9A1ALDH1A1LMNAMAPK1KDM4E | |
| SCHEMBL8575409 | 0.87 | KDM4E (0.39) | SLC9A1ALDH1A1LMNAMAPK1PIK3CD | |
| SCHEMBL8603912 | 0.83 | CA12 (0.49) | ALDH1A1LMNAKDM4EHSD17B10 | |
| SCHEMBL8043633 | 0.81 | GABRP (0.36) | ALDH1A1LMNAMAPK1PIK3CDPIK3CA | |
| SCHEMBL8576497 | 0.81 | KDM4E (0.35) | SLC9A1ALDH1A1LMNAMAPK1PIK3CD | |
| SCHEMBL5190885 | 0.81 | SLC9A1 (0.59) | SLC9A1ALDH1A1LMNAMAPK1KDM4E | |
| SCHEMBL8574141 | 0.80 | KDM4E (0.49) | ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL8043534 | 0.80 | SLC9A1 (0.72) | SLC9A1 | |
| SCHEMBL8576417 | 0.79 | NOTUM (0.34) | ALDH1A1LMNAMAPK1PIK3CDPIK3CA | |
| SCHEMBL8571645 | 0.79 | XDH (0.35) | SLC9A1ALDH1A1LMNAMAPK1PIK3CD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0704431-B1 | Ortho-substituted benzoic acid derivatives | MERCK PATENT GMBH (DE) | 2000-05-24 | — | — | EP | disclosed |
| US-5849796-A | Ortho-substituted benzoil acid derivatives | MERCK PATENT GELSELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-12-15 | — | — | US | disclosed |
| EP-0704431-A2 | Ortho-substituted benzoic acid derivatives | MERCK PATENT GmbH (DE) | 1996-04-03 | — | — | EP | disclosed |