Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.41 |
| ▸ | PLK1 | P53350 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.40 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.40 |
| ▸ | PDE5A | O76074 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL28235970 | 0.86 | RAB9A (0.60) | RAB9ANPC1POLBPLK1ALDH1A1 | |
| SCHEMBL10053685 | 0.81 | GAA (0.45) | RAB9ANPC1POLBLMNAMAPK1 | |
| SCHEMBL583230 | 0.77 | RAB9A (0.48) | RAB9ANPC1ALDH1A1LMNAMAPK1 | |
| SCHEMBL583633 | 0.76 | HTT (0.61) | RAB9ANPC1POLBALDH1A1SMN1; SMN2 | |
| SCHEMBL583233 | 0.75 | KMT2A (0.54) | RAB9ANPC1ALDH1A1LMNACYP3A4 | |
| SCHEMBL29475007 | 0.75 | CA2 (0.68) | POLBABCB1ALDH1A1CYP3A4CA2 | |
| SCHEMBL318036 | 0.75 | CA2 (0.68) | POLBABCB1ALDH1A1CYP3A4CA2 | |
| SCHEMBL16458177 | 0.74 | LMNA (0.53) | RAB9ANPC1ALDH1A1LMNACYP3A4 | |
| SCHEMBL16460040 | 0.71 | NFE2L2 (0.64) | POLBABCB1ALDH1A1USP2LMNA | |
| SCHEMBL16460041 | 0.71 | NFE2L2 (0.64) | POLBABCB1ALDH1A1USP2LMNA |
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-108456178-A | Ligustrazine with neuroprotective activity replaces p-Hydroxybenzylalcohol analog derivative（LQC-F）And its application | 雷鹏程 | 2018-08-28 | — | — | CN | disclosed |