Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.42 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.39 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PLIN5 | Q00G26 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ABHD5 | Q8WTS1 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 2/20 | 0.37 |
| ▸ | CTSK | P43235 | 2/20 | 0.37 |
| ▸ | FNTA | P49354 | 1/20 | 0.37 |
| ▸ | FNTB | P49356 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | GSTP1 | P09211 | 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 | |
|---|---|---|---|---|
| SCHEMBL3873193 | 0.94 | EPHX2 (0.42) | EPHX2GGPS1KLK5KDM4EALDH1A1 | |
| SCHEMBL13897379 | 0.92 | GSTP1 (0.42) | EPHX2GGPS1KLK5KDM4EALDH1A1 | |
| SCHEMBL3862993 | 0.92 | FNTA (0.44) | EPHX2GGPS1ALDH1A1ALOX5CTSS | |
| SCHEMBL3871194 | 0.92 | GSTP1 (0.42) | EPHX2GGPS1KLK5KDM4EALDH1A1 | |
| SCHEMBL13897413 | 0.90 | EPHX2 (0.44) | EPHX2GGPS1KLK5KDM4EALDH1A1 | |
| SCHEMBL3864792 | 0.87 | FNTA (0.43) | EPHX2GGPS1KDM4EALDH1A1NPC1 | |
| SCHEMBL3863222 | 0.86 | PPARA (0.43) | EPHX2GGPS1ALOX5CTSSCTSK | |
| SCHEMBL13897480 | 0.86 | PPARA (0.43) | EPHX2GGPS1ALOX5CTSSCTSK | |
| SCHEMBL3867006 | 0.86 | BCHE (0.44) | EPHX2GGPS1KLK5KDM4EALDH1A1 | |
| SCHEMBL3863211 | 0.85 | GGPS1 (0.45) | EPHX2GGPS1KLK5MAPTALOX5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1814869-A2 | SUBSTITUTED AMINO ACIDS AS PROTEIN TYROSINE PHOSPHATASE INHIBITORS | The Institutes for Pharmaceutical Discovery, LLC (US) | 2007-08-08 | — | — | EP | claimed |
| WO-2006055725-A2 | SUBSTITUTED AMINO ACIDS AS PROTEIN TYROSINE PHOSPHATASE INHIBITORS | THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) | 2006-05-26 | — | — | WO | claimed |