Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | TTR | P02766 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.38 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.38 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HPD | P32754 | 1/20 | 0.37 |
| ▸ | CASP6 | P55212 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10779478 | 1.00 | ATM (0.45) | ATMTDP1ALDH1A1HTTGAA | |
| SCHEMBL2527070 | 0.86 | TSHR (0.53) | ATMTDP1ALDH1A1HTTGAA | |
| SCHEMBL112748 | 0.84 | THRB (0.45) | ATMTDP1ALDH1A1HTTGAA | |
| SCHEMBL2531381 | 0.83 | ALDH1A1 (0.40) | TDP1ALDH1A1HTTGAANPC1 | |
| SCHEMBL1343471 | 0.83 | TDP1 (0.45) | ATMTDP1ALDH1A1HTTGAA | |
| SCHEMBL5150306 | 0.83 | TDP1 (0.45) | ATMTDP1ALDH1A1HTTGAA | |
| SCHEMBL3714548 | 0.82 | ATM (0.50) | ATMTDP1ALDH1A1HTTTTR | |
| SCHEMBL3714543 | 0.82 | ATM (0.50) | ATMTDP1ALDH1A1HTTTTR | |
| SCHEMBL28015054 | 0.82 | ATM (0.39) | ATMTDP1ALDH1A1HTTGAA | |
| SCHEMBL11683508 | 0.82 | MAPK1 (0.45) | ALDH1A1HTTL3MBTL1NPC1GLA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0032620-B2 | Process for preparing therapeutic 2-arylpropionic acids and esters, and novel arylmethylmalonate esters | THE UPJOHN COMPANY (US) | 1987-02-04 | — | — | EP | disclosed |
| EP-0032620-B1 | Process for preparing therapeutic 2-arylpropionic acids and esters, and novel arylmethylmalonate esters | THE UPJOHN COMPANY (US) | 1984-05-30 | — | — | EP | disclosed |
| US-4398035-A | INTERMEDIATE FOR FLURBIPROFEN | THE UPJOHN COMPANY (US) | 1983-08-09 | — | — | US | disclosed |
| US-4324904-A | COMPOUND USEFUL IN MAKING FLURBIPROFEN | THE UPJOHN COMPANY (US) | 1982-04-13 | — | — | US | disclosed |
| EP-0032620-A1 | Process for preparing therapeutic 2-arylpropionic acids and esters, and novel arylmethylmalonate esters | THE UPJOHN COMPANY (US) | 1981-07-29 | — | — | EP | disclosed |