Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.50 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.50 |
| ▸ | TACR1 | P25103 | 1/20 | 0.43 |
| ▸ | TACR3 | P29371 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL29253671 | 1.00 | RIPK1 (0.50) | RIPK1SLC1A2TACR1TACR3POLB | |
| SCHEMBL29253680 | 0.82 | SLC1A2 (0.54) | RIPK1SLC1A2POLBHPGDALDH1A1 | |
| SCHEMBL29253631 | 0.82 | KMT2A (0.56) | SLC1A2HPGDTSHRKMT2A | |
| SCHEMBL29253670 | 0.82 | KMT2A (0.56) | SLC1A2HPGDTSHRKMT2A | |
| SCHEMBL29253705 | 0.82 | SLC1A2 (0.54) | RIPK1SLC1A2POLBHPGDALDH1A1 | |
| SCHEMBL29253682 | 0.82 | SLC1A2 (0.54) | RIPK1SLC1A2POLBHPGDALDH1A1 | |
| SCHEMBL2905073 | 0.78 | SLC1A2 (0.65) | RIPK1SLC1A2HPGDALDH1A1MAPT | |
| SCHEMBL10172968 | 0.77 | RIPK1 (0.61) | RIPK1SLC1A2HTTHPGDALDH1A1 | |
| SCHEMBL30968603 | 0.75 | CTSS (0.57) | RIPK1SLC1A2CTSSCTSKKMT2A | |
| SCHEMBL30968604 | 0.75 | CTSS (0.57) | RIPK1SLC1A2CTSSCTSKKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-118302410-A | Deuterated functionalized derivatives of alpha-alanine, in particular for the treatment of neurological diseases | 雅盖隆大学 | 2024-07-05 | — | — | CN | disclosed |