Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | PPARG | P37231 | 1/20 | 0.61 |
| ▸ | PPARD | Q03181 | 1/20 | 0.61 |
| ▸ | PPARA | Q07869 | 1/20 | 0.61 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | LDHA | P00338 | 1/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.47 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7363781 | 1.00 | ALDH1A1 (0.61) | ALDH1A1PPARGPPARDPPARACA2 | |
| SCHEMBL13729659 | 0.85 | ALDH1A1 (0.44) | ALDH1A1PPARGPPARDPPARAPTGS1 | |
| SCHEMBL13728856 | 0.85 | ALDH1A1 (0.44) | ALDH1A1PPARGPPARDPPARAPTGS1 | |
| SCHEMBL7361212 | 0.84 | RECQL (0.51) | POLB | |
| SCHEMBL21344953 | 0.83 | ATM (0.54) | ALDH1A1PPARGPPARDPPARACA2 | |
| SCHEMBL11911908 | 0.83 | ALDH1A1 (0.71) | ALDH1A1PPARGPPARDPPARACA2 | |
| SCHEMBL11911904 | 0.83 | ALDH1A1 (0.71) | ALDH1A1PPARGPPARDPPARACA2 | |
| SCHEMBL28971730 | 0.80 | PTGS2 (0.52) | ALDH1A1KDM4EMAPTCYP3A4POLB | |
| SCHEMBL16796998 | 0.80 | NPC1 (0.51) | ALDH1A1MEN1MAPTKMT2ASMN1; SMN2 | |
| SCHEMBL27313293 | 0.79 | ALDH1A1 (0.67) | ALDH1A1PPARGPPARDPPARACA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0538384-A4 | OXAMIDES | SMITHKLINE BEECHAM CORP (US) | 1995-04-12 | — | — | EP | disclosed |
| US-5393788-A | Phenylalkyl oxamides | SMITHKLINE BEECHAM CORPORATION (US) | 1995-02-28 | — | — | US | disclosed |
| EP-0538384-A1 | OXAMIDES | SMITHKLINE BEECHAM CORPORATION (US) | 1993-04-28 | — | — | EP | disclosed |
| WO-1992000968-A1 | OXAMIDES | SMITHKLINE BEECHAM CORPORATION (US) | 1992-01-23 | — | — | WO | disclosed |