Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.55 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.55 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.55 |
| ▸ | OXTR | P30559 | 1/20 | 0.52 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.52 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL31305922 | 0.92 | CXCR4 (0.59) | HTTALDH1A1KMT2ANPC1RAB9A | |
| SCHEMBL15718994 | 0.86 | CXCR4 (0.54) | HTTALDH1A1KMT2ANPC1RAB9A | |
| SCHEMBL17182961 | 0.86 | CXCR4 (0.54) | HTTALDH1A1KMT2ANPC1RAB9A | |
| SCHEMBL15718995 | 0.86 | CXCR4 (0.54) | HTTALDH1A1KMT2ANPC1RAB9A | |
| SCHEMBL353907 | 0.84 | CXCR4 (0.53) | HTTALDH1A1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL18088394 | 0.81 | RAB9A (0.60) | KMT2AHDAC6NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8826390 | 0.81 | HTT (0.58) | HTTALDH1A1HDAC6NPC1RAB9A | |
| SCHEMBL5074162 | 0.80 | HDAC6 (0.52) | HTTALDH1A1KMT2AHDAC6RAB9A | |
| SCHEMBL20535307 | 0.80 | HDAC6 (0.68) | ALDH1A1KMT2AHDAC6NPC1RAB9A | |
| SCHEMBL3861590 | 0.80 | HDAC6 (0.62) | ALDH1A1KMT2AHDAC6NPC1RAB9A |
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-3707132-B1 | NEW METHOD FOR THE SYNTHESIS OF UNSYMMETRICAL TERTIARY AMINES | UNIV PARIS SACLAY (FR) | 2024-07-17 | — | — | EP | disclosed |