Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MASP2 | O00187 | 1/20 | 0.41 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7089269 | 0.86 | ALDH1A1 (0.56) | ALDH1A1HTTTSHRMASP2ABCC1 | |
| SCHEMBL30761772 | 0.86 | ALDH1A1 (0.56) | ALDH1A1HTTTSHRMASP2ABCC1 | |
| SCHEMBL4048833 | 0.78 | GAA (0.53) | ALDH1A1HTTTSHRKDM4EKMT2A | |
| SCHEMBL5814278 | 0.78 | NPC1 (0.64) | ALDH1A1HTTKDM4EKMT2A | |
| SCHEMBL30782571 | 0.78 | GAA (0.53) | ALDH1A1HTTTSHRKDM4EKMT2A | |
| SCHEMBL840655 | 0.78 | ALDH1A1 (0.61) | ALDH1A1HTTTSHRKDM4EKMT2A | |
| SCHEMBL3837851 | 0.78 | MAPT (0.52) | ALDH1A1HTTTSHR | |
| SCHEMBL23169175 | 0.77 | HTT (0.64) | ALDH1A1HTTKMT2A | |
| SCHEMBL7202775 | 0.77 | TP53 (0.59) | ALDH1A1HTTTSHR | |
| SCHEMBL560265 | 0.77 | CYP1A2 (0.55) | ALDH1A1TSHRKMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5614498-A | OLIGOPEPTIDES, BRONCHDILATORS | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1997-03-25 | — | — | US | disclosed |
| US-5496928-A | Endothelin antagonistic substance | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1996-03-05 | — | — | US | disclosed |
| EP-0555537-A2 | Endothelin antagonistic substance | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1993-08-18 | — | — | EP | disclosed |