Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MME | P08473 | 6/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | ACE | P12821 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ECE1 | P42892 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | NPEPPS | P55786 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.44 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.44 |
| ▸ | ITGAV | P06756 | 1/20 | 0.44 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.44 |
| ▸ | ABAT | P80404 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11717076 | 0.84 | ALDH1A1 (0.50) | ALDH1A1MAPTHPGDMAPK1MEN1 | |
| SCHEMBL13846307 | 0.81 | CTSD (0.44) | ALDH1A1MAPTMAPK1KDM4EGAA | |
| SCHEMBL9829411 | 0.81 | CNR1 (0.62) | MMEMEN1KMT2AKDM4ECNR1 | |
| SCHEMBL11845564 | 0.80 | NAAA (0.43) | ALDH1A1MAPTMEN1KMT2AKDM4E | |
| SCHEMBL30175033 | 0.80 | KMT2A (0.55) | MMEMEN1KMT2AGAA | |
| SCHEMBL7112889 | 0.80 | CYP3A4 (0.53) | ALDH1A1MAPTMEN1KMT2AKDM4E | |
| Water SCHEMBL28078269 | 0.80 | CTSD (0.43) | ALDH1A1MAPTMAPK1KDM4EGAA | |
| SCHEMBL11628924 | 0.79 | NAAA (0.57) | MMEALDH1A1ACEMAPTHPGD | |
| SCHEMBL7330779 | 0.79 | CTSS (0.54) | — | |
| SCHEMBL11629718 | 0.78 | MME (0.54) | MMEALDH1A1ACEMAPTHPGD |
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-4567267-A | α-Phenyl-2-(aza)benzothiazolylthioglycolic acids and derivatives thereof | AMERICAN HOME PRODUCTS CORPORATION (US) | 1986-01-28 | — | — | US | disclosed |