Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.39 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA3 | P07451 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA6 | P23280 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8574164 | 0.86 | CA12 (0.46) | ALDH1A1LMNAMAPK1SLC9A1GLO1 | |
| SCHEMBL8576432 | 0.84 | ALDH1A1 (0.39) | ALDH1A1LMNAMAPK1SLC9A1GLO1 | |
| SCHEMBL8574336 | 0.83 | ALDH1A1 (0.37) | ALDH1A1LMNASLC9A1CA1CA2 | |
| SCHEMBL8574529 | 0.83 | CISD1 (0.45) | ALDH1A1LMNACA12CA1CA2 | |
| SCHEMBL8576497 | 0.81 | KDM4E (0.35) | ALDH1A1LMNAMAPK1SLC9A1CA12 | |
| SCHEMBL8534253 | 0.80 | SLC9A1 (0.63) | SLC9A1 | |
| SCHEMBL8576915 | 0.78 | CA12 (0.56) | ALDH1A1LMNAMAPK1SLC9A1GLO1 | |
| SCHEMBL13751701 | 0.76 | ALDH1A1 (0.49) | ALDH1A1LMNAMAPK1SLC9A1GLO1 | |
| SCHEMBL11821417 | 0.75 | L3MBTL1 (0.46) | ALDH1A1LMNAMAPK1SLC9A1L3MBTL1 | |
| SCHEMBL31401278 | 0.75 | ALDH1A1 (0.42) | ALDH1A1LMNAMAPK1SLC9A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-5849796-A | Ortho-substituted benzoil acid derivatives | MERCK PATENT GELSELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-12-15 | — | — | US | disclosed |