Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | ADORA2B | P29275 | 8/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | POLB | P06746 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | APEX1 | P27695 | 1/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL18998666 | 0.79 | ALDH1A1 (0.53) | NPC1ADORA2BALDH1A1POLBTDP1 | |
| SCHEMBL20614560 | 0.77 | KDM4E (0.49) | NPC1ADORA2BALDH1A1POLBTDP1 | |
| SCHEMBL11660644 | 0.75 | TSHR (0.55) | NPC1ALDH1A1KDM4EMAPTTSHR | |
| SCHEMBL11660640 | 0.75 | TSHR (0.55) | NPC1ALDH1A1KDM4EMAPTTSHR | |
| SCHEMBL27322396 | 0.73 | ADORA2B (0.41) | ADORA2BALDH1A1POLBTDP1KDM4E | |
| SCHEMBL16708942 | 0.71 | ESR2 (0.52) | ALDH1A1POLBKDM4EESR2LMNA | |
| SCHEMBL21065269 | 0.71 | ESR2 (0.52) | ALDH1A1POLBKDM4EESR2LMNA | |
| SCHEMBL1298246 | 0.71 | MAPT (0.50) | ALDH1A1LMNAMAPTHSD17B10MEN1 | |
| SCHEMBL6736374 | 0.71 | MAPT (0.50) | ALDH1A1LMNAMAPTHSD17B10MEN1 | |
| SCHEMBL11661818 | 0.71 | ALDH1A1 (0.45) | NPC1ALDH1A1KDM4EL3MBTL1MAPT |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6291520-B1 | INHIBIT THE ENZYME LIPOXYGENASE; TREATMENT OR ALLEVIATION OF INFLAMMATORY DISEASES, ALLERGIC CONDITIONS AND CARDIOVASCULAR DISEASES | PFIZER | 2001-09-18 | — | — | US | disclosed |
| CN-1029230-C | Hydroxamic acid and N-hydroxyurea derivatives and their use | PFIZER (US) | 1995-07-05 | — | — | CN | disclosed |
| EP-0559743-B1 | NOVEL HYDROXAMIC ACID AND N-HYDROXYUREA DERIVATIVES AND THEIR USE | PFIZER (US) | 1995-03-08 | — | — | EP | disclosed |
| EP-0559743-A1 | NOVEL HYDROXAMIC ACID AND N-HYDROXYUREA DERIVATIVES AND THEIR USE. | PFIZER HOSPITAL PROD (US) | 1993-09-15 | — | — | EP | disclosed |
| WO-1992009566-A1 | NOVEL HYDROXAMIC ACID AND N-HYDROXYUREA DERIVATIVES AND THEIR USE | PFIZER INC. (US) | 1992-06-11 | — | — | WO | disclosed |
| CN-1061775-A | New hydroxamic acid and N-hydroxyl urea derivant and uses thereof | PFIZER (US) | 1992-06-10 | — | — | CN | disclosed |