Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.33 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 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 | |
|---|---|---|---|---|
| SCHEMBL6965178 | 0.80 | ALDH1A1 (0.43) | ALDH1A1TSHRL3MBTL1MAPTHPGD | |
| SCHEMBL443597 | 0.80 | ALDH1A1 (0.43) | ALDH1A1TSHRL3MBTL1NPC1MAPT | |
| Hydrochloric Acid SCHEMBL6969794 | 0.79 | ALDH1A1 (0.42) | ALDH1A1TSHRL3MBTL1MAPTHPGD | |
| SCHEMBL8593312 | 0.75 | ALDH1A1 (0.39) | ALDH1A1TSHRL3MBTL1MAPTHPGD | |
| SCHEMBL8546560 | 0.72 | ALDH1A1 (0.42) | ALDH1A1TSHRL3MBTL1MAPTHPGD | |
| SCHEMBL8552649 | 0.70 | ALDH1A1 (0.40) | ALDH1A1TSHRL3MBTL1MAPTHPGD | |
| SCHEMBL4872833 | 0.70 | ALDH1A1 (0.53) | ALDH1A1TSHRL3MBTL1NPC1HPGD | |
| SCHEMBL8818395 | 0.70 | ALDH1A1 (0.53) | ALDH1A1TSHRL3MBTL1NPC1HPGD | |
| SCHEMBL8551258 | 0.69 | ALDH1A1 (0.38) | ALDH1A1TSHRL3MBTL1HPGDACHE | |
| SCHEMBL6980172 | 0.68 | ALDH1A1 (0.43) | ALDH1A1TSHRL3MBTL1MAPTHPGD |
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-0824523-A1 | NITRIC OXIDE SYNTHASE INHIBITORS DERIVED FROM CYCLIC AMIDINES | G.D. Searle & Co. (US) | 1998-02-25 | — | — | EP | disclosed |
| WO-1996035677-A1 | NITRIC OXIDE SYNTHASE INHIBITORS DERIVED FROM CYCLIC AMIDINES | G.D. SEARLE & CO. (US) | 1996-11-14 | — | — | WO | disclosed |