Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 2/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.42 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.42 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.42 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 3/20 | 0.40 |
| ▸ | LOX | P28300 | 1/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.38 |
| ▸ | KMT5B | Q4FZB7 | 1/20 | 0.38 |
| ▸ | KMT5C | Q86Y97 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.38 |
| ▸ | RIPK3 | Q9Y572 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL29862588 | 0.85 | ALK (0.47) | HTR1AADRA1DADRA1AADRA1BIRAK4 | |
| Hydrochloric Acid SCHEMBL23360666 | 0.85 | ALK (0.47) | HTR1AADRA1DADRA1AADRA1BIRAK4 | |
| SCHEMBL19576192 | 0.79 | IDO1 (0.51) | AR | |
| SCHEMBL12629435 | 0.76 | HTR1A (0.53) | HTR1AADRA1DADRA1AADRA1BPDGFRB | |
| SCHEMBL23360413 | 0.76 | PDE4D (0.52) | — | |
| SCHEMBL29862539 | 0.76 | PDE4D (0.52) | — | |
| Hydrochloric Acid SCHEMBL23360586 | 0.74 | TGFBR1 (0.48) | HTR1AADRA1DADRA1AADRA1BIRAK4 | |
| SCHEMBL26086368 | 0.74 | GAK (0.47) | HTR1AADRA1DADRA1AADRA1BKMT5B | |
| SCHEMBL10025294 | 0.73 | HTR1A (0.34) | RIPK1HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL13016435 | 0.72 | SRC (0.38) | IRAK4ARALDH1A1PREP |
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-3293177-A1 | TYROSINE KINASE INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME | GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) | 2018-03-14 | — | — | EP | disclosed |