Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.40 |
| ▸ | FNTA | P49354 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11297351 | 1.00 | ALDH1A1 (0.43) | ALDH1A1MAPTTSHRMAPK1TDP1 | |
| SCHEMBL11298311 | 0.98 | ALDH1A1 (0.42) | ALDH1A1MAPTTSHRMAPK1TDP1 | |
| SCHEMBL11298312 | 0.98 | ALDH1A1 (0.42) | ALDH1A1MAPTTSHRMAPK1TDP1 | |
| SCHEMBL11301345 | 0.84 | TP53 (0.43) | ALDH1A1TDP1LMNAHTTSMN1; SMN2 | |
| SCHEMBL11301348 | 0.84 | TP53 (0.43) | ALDH1A1TDP1LMNAHTTSMN1; SMN2 | |
| SCHEMBL11301938 | 0.83 | TSHR (0.44) | TSHRMAPK1HTTSMN1; SMN2L3MBTL1 | |
| SCHEMBL11301936 | 0.83 | TSHR (0.44) | TSHRMAPK1HTTSMN1; SMN2L3MBTL1 | |
| SCHEMBL11303482 | 0.82 | CTBP2 (0.49) | ALDH1A1HTTSMN1; SMN2CTBP2MEN1 | |
| SCHEMBL11303480 | 0.82 | CTBP2 (0.49) | ALDH1A1HTTSMN1; SMN2CTBP2MEN1 | |
| SCHEMBL25242715 | 0.81 | CTBP2 (0.46) | ALDH1A1MAPTTSHRMAPK1TDP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4254048-A | ANTIINFLAMMATORY AGENTS; FOR ARTHRITIS | AMERICAN CYANAMID COMPANY (US) | 1981-03-03 | — | — | US | claimed |
| EP-0016277-B1 | 2-CARBONYL-3-HYDROXY-ALKENONITRILES, THEIR USE AS ANTI-ARTHRITIC AGENTS AND PROCESSES FOR THEIR PREPARATION | AMERICAN CYANAMID COMPANY (US) | 1981-12-02 | — | — | EP | disclosed |
| US-4254048-A | ANTIINFLAMMATORY AGENTS; FOR ARTHRITIS | AMERICAN CYANAMID COMPANY (US) | 1981-03-03 | — | — | US | disclosed |
| WO-1980000964-A1 | ANTI-INFLAMMATORY AGENTS INCLUDING 2-CARBONYL-3-HYDROXY-2-ALKENONITRILES | AMERICAN CYANAMID CO (US) | 1980-05-15 | — | — | WO | disclosed |