Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | BCL2A1 | Q16548 | 3/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | LSS | P48449 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10157120 | 0.76 | ALDH1A1 (0.58) | ALDH1A1HTTRAB9ASMN1; SMN2PYCR1 | |
| SCHEMBL23641242 | 0.72 | ALDH1A1 (0.56) | ALDH1A1HTTRAB9ASMN1; SMN2PYCR1 | |
| SCHEMBL25969225 | 0.70 | ALDH1A1 (0.50) | ALDH1A1HTTRAB9ASMN1; SMN2PYCR1 | |
| SCHEMBL13769106 | 0.70 | ALDH1A1 (0.58) | ALDH1A1HTTRAB9ASMN1; SMN2PYCR1 | |
| SCHEMBL6412640 | 0.70 | ALDH1A1 (0.68) | ALDH1A1HTTRAB9ASMN1; SMN2PYCR1 | |
| SCHEMBL11300231 | 0.68 | ALDH1A1 (0.66) | ALDH1A1HTTRAB9ASMN1; SMN2PYCR1 | |
| SCHEMBL20432353 | 0.67 | RAB9A (0.50) | ALDH1A1HTTRAB9ASMN1; SMN2PYCR1 | |
| SCHEMBL17887509 | 0.65 | ALDH1A1 (0.61) | ALDH1A1HTTRAB9ASMN1; SMN2PYCR1 | |
| SCHEMBL9824160 | 0.65 | ALDH1A1 (0.70) | ALDH1A1HTTRAB9ASMN1; SMN2NPC1 | |
| SCHEMBL18610236 | 0.65 | ALDH1A1 (0.47) | ALDH1A1HTTRAB9ASMN1; SMN2PYCR1 |
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-3110810-B1 | PYRAZOLE AMIDE DERIVATIVE | TEIJIN PHARMA LTD (JP) | 2018-05-02 | — | — | EP | disclosed |