Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23838593 | 0.70 | NPC1 (0.46) | TDP1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL15383451 | 0.70 | ALDH1A1 (0.48) | NPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL18945729 | 0.69 | ALDH1A1 (0.41) | NPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL18945760 | 0.68 | ALDH1A1 (0.48) | NPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL18945912 | 0.66 | CDH1 (0.49) | NPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL15384704 | 0.66 | ALDH1A1 (0.47) | NPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL18082979 | 0.64 | KDM4E (0.45) | TDP1KMT2APDE10AMAPTALDH1A1 | |
| SCHEMBL18945927 | 0.64 | NAMPT (0.47) | MAPT | |
| SCHEMBL18945307 | 0.64 | ALDH1A1 (0.43) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL18082994 | 0.64 | KDM4E (0.47) | TDP1KMT2APDE10AMAPTALDH1A1 |
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-2661428-B1 | QUINOXALINES AND AZA-QUINOXALINES AS CRTH2 RECEPTOR MODULATORS | MERCK SHARP & DOHME (US) | 2017-06-07 | — | — | EP | disclosed |