Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30557514 | 0.90 | ALDH1A1 (0.47) | ALDH1A1HTTTSHRMAOBHPGD | |
| SCHEMBL19925330 | 0.84 | ALDH1A1 (0.47) | ALDH1A1HTTTSHRMAOBHPGD | |
| SCHEMBL10389234 | 0.78 | ALDH1A1 (0.53) | ALDH1A1HTTTSHRMAOBHPGD | |
| SCHEMBL7594453 | 0.76 | MAOB (0.50) | ALDH1A1HTTTSHRMAOBHPGD | |
| SCHEMBL28339719 | 0.75 | ALDH1A1 (0.58) | ALDH1A1HTTTSHRMAOBHPGD | |
| SCHEMBL291637 | 0.75 | ALDH1A1 (0.58) | ALDH1A1HTTTSHRMAOBHPGD | |
| SCHEMBL10404273 | 0.75 | ALDH1A1 (0.50) | ALDH1A1HTTTSHRMAOBHPGD | |
| SCHEMBL7858248 | 0.75 | ALDH1A1 (0.50) | ALDH1A1HTTTSHRMAOBHPGD | |
| SCHEMBL77922 | 0.75 | ALDH1A1 (0.62) | ALDH1A1HTTTSHRMAOBHPGD | |
| SCHEMBL29570427 | 0.74 | ALDH1A1 (0.49) | ALDH1A1HTTTSHRMAOBHPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-117903297-A | Chemoselective coupling of sulfhydryl groups with alkenyl or alkynyl phosphoramides | 柏林合作研究学会 | 2024-04-19 | — | — | CN | disclosed |
| CN-109689112-B | Chemoselective coupling of sulfhydryl groups with alkenyl or alkynyl phosphoramides | 柏林合作研究学会 | 2023-10-13 | — | — | CN | disclosed |
| CN-109689112-A | Coupling of chemoselective thiol groups to alkenyl or alkynyl phosphoramides | 柏林合作研究学会 | 2019-04-26 | — | — | CN | disclosed |