Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPD | P32754 | 5/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20060183 | 0.81 | NPC1 (0.35) | HPDMAPTNPC1ALDH1A1POLB | |
| SCHEMBL20060194 | 0.80 | ALDH1A1 (0.37) | HPDMAPTNPC1ALDH1A1POLB | |
| SCHEMBL20060196 | 0.79 | CTSD (0.39) | HPDMAPTNPC1ALDH1A1RAB9A | |
| SCHEMBL20060138 | 0.77 | RAB9A (0.38) | MAPTNPC1ALDH1A1POLBRAB9A | |
| SCHEMBL18235403 | 0.77 | HPD (0.38) | HPDNPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL20060147 | 0.74 | P2RX7 (0.38) | HPD | |
| SCHEMBL20060173 | 0.73 | KDM4E (0.35) | MAPTNPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL20060139 | 0.73 | CMA1 (0.39) | HPDMAPTNPC1ALDH1A1TSHR | |
| SCHEMBL20059994 | 0.73 | NPC1 (0.36) | MAPTNPC1ALDH1A1POLBRAB9A | |
| SCHEMBL20060195 | 0.72 | MEN1 (0.40) | ALDH1A1POLBSMN1; SMN2 |
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-2595987-B1 | NEW AMINOPYRAZOLOQUINAZOLINES | BOEHRINGER INGELHEIM INT (DE) | 2018-04-18 | — | — | EP | disclosed |