Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 5/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.33 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.33 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11152345 | 0.87 | CYP19A1 (0.35) | HDAC1GAAMAPK1ALDH1A1HDAC6 | |
| SCHEMBL11150524 | 0.85 | MEN1 (0.32) | HDAC1GAAHDAC6GRIN2DGRIN3B | |
| SCHEMBL30853648 | 0.85 | TSHR (0.36) | HDAC1MAPK1SMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL140210 | 0.85 | TSHR (0.36) | HDAC1MAPK1SMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL11152319 | 0.83 | HDAC1 (0.36) | HDAC1HDAC2HDAC3ALDH1A1HDAC6 | |
| SCHEMBL11149555 | 0.82 | HDAC1 (0.36) | HDAC1HDAC2HDAC3ALDH1A1TSHR | |
| SCHEMBL11154571 | 0.82 | MEN1 (0.41) | HDAC1HDAC2MAPK1SMN1; SMN2ALDH1A1 | |
| SCHEMBL11160201 | 0.81 | HDAC1 (0.34) | HDAC1ALDH1A1HDAC6 | |
| SCHEMBL11156490 | 0.80 | POLB (0.37) | HDAC1MAPK1ALDH1A1HDAC6 | |
| SCHEMBL11162250 | 0.80 | ALDH1A1 (0.42) | MAPK1SMN1; SMN2ALDH1A1TSHR |
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-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 |
| US-4266069-A | Processes for the preparation of hydratropic acids and esters | THE UPJOHN COMPANY (US) | 1981-05-05 | — | — | US | disclosed |