Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GSK3B | P49841 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL8818395 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TSHRHPGDL3MBTL1ACHE | |
| SCHEMBL4872833 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TSHRHPGDL3MBTL1ACHE | |
| SCHEMBL14635790 | 0.73 | GRM2 (0.43) | ALDH1A1TSHRHTTMEN1KMT2A | |
| SCHEMBL10378250 | 0.71 | ALDH1A1 (0.50) | ALDH1A1TSHRHPGDL3MBTL1ACHE | |
| SCHEMBL28594366 | 0.69 | ALDH1A1 (0.45) | ALDH1A1TSHRHPGDL3MBTL1ACHE | |
| SCHEMBL30825621 | 0.68 | ALDH1A1 (0.48) | ALDH1A1TSHRHPGDL3MBTL1ACHE | |
| SCHEMBL29169531 | 0.68 | ALDH1A1 (0.48) | ALDH1A1TSHRHPGDL3MBTL1ACHE | |
| SCHEMBL8548653 | 0.67 | NOS3 (0.38) | — | |
| SCHEMBL8507863 | 0.67 | ALDH1A1 (0.45) | ALDH1A1TSHRHPGDL3MBTL1ACHE | |
| SCHEMBL28663778 | 0.67 | CRBN (0.50) | ALDH1A1TSHRHPGDL3MBTL1ACHE |
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 |