Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.46 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.46 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | XDH | P47989 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | GUCY1B2 | O75343 | 1/20 | 0.43 |
| ▸ | GUCY1A2 | P33402 | 1/20 | 0.43 |
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.43 |
| ▸ | GUCY1B1 | Q02153 | 1/20 | 0.43 |
| ▸ | TTR | P02766 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30891041 | 0.81 | ALDH1A1 (0.49) | ALDH1A1TXNRD1TXNRD3TXNRD2MEN1 | |
| SCHEMBL3567491 | 0.81 | ALDH1A1 (0.49) | ALDH1A1TXNRD1TXNRD3TXNRD2MEN1 | |
| SCHEMBL3720824 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TXNRD1TXNRD3TXNRD2MEN1 | |
| SCHEMBL1551650 | 0.78 | SMN1; SMN2 (0.50) | ALDH1A1TXNRD1TXNRD3TXNRD2MEN1 | |
| SCHEMBL1207982 | 0.75 | ALDH1A1 (0.57) | ALDH1A1TXNRD1TXNRD3TXNRD2MEN1 | |
| SCHEMBL620331 | 0.74 | ALDH1A1 (0.49) | ALDH1A1TXNRD1TXNRD3TXNRD2MEN1 | |
| SCHEMBL9040006 | 0.74 | GUCY1B2 (0.46) | ALDH1A1TXNRD1TXNRD3TXNRD2MEN1 | |
| SCHEMBL30891215 | 0.74 | RAB9A (0.52) | ALDH1A1TXNRD1TXNRD3TXNRD2MEN1 | |
| SCHEMBL3563953 | 0.74 | RAB9A (0.52) | ALDH1A1TXNRD1TXNRD3TXNRD2MEN1 | |
| SCHEMBL7305061 | 0.73 | TLR9 (0.50) | ALDH1A1MEN1KMT2ARAB9ANPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0587311-A1 | Peptides capable of inhibiting the activity of HIV protease, their preparation and their therapeutic use | SANKYO COMPANY LIMITED (JP) | 1994-03-16 | — | — | EP | disclosed |