Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.41 |
| ▸ | USP28 | Q96RU2 | 1/20 | 0.39 |
| ▸ | USP25 | Q9UHP3 | 1/20 | 0.39 |
| ▸ | BCL2A1 | Q16548 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CXCR3 | P49682 | 3/20 | 0.37 |
| ▸ | KIT | P10721 | 1/20 | 0.37 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | XIAP | P98170 | 1/20 | 0.35 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2418856 | 0.90 | HRH4 (0.43) | HRH4BCL2A1ALDH1A1LMNACXCR3 | |
| SCHEMBL4848635 | 0.90 | HRH4 (0.43) | HRH4BCL2A1ALDH1A1LMNACXCR3 | |
| SCHEMBL18901953 | 0.85 | KIT (0.37) | HRH4ALDH1A1KITADRA2AADRA2B | |
| SCHEMBL2417605 | 0.83 | HRH4 (0.41) | HRH4USP28USP25BCL2A1ALDH1A1 | |
| SCHEMBL18901967 | 0.82 | USP28 (0.46) | USP28USP25 | |
| SCHEMBL2421495 | 0.81 | CXCR3 (0.41) | HRH4USP28USP25BCL2A1CXCR3 | |
| SCHEMBL2422155 | 0.80 | HRH4 (0.55) | HRH4BCL2A1ALDH1A1LMNACXCR3 | |
| SCHEMBL2420637 | 0.80 | CXCR3 (0.40) | HRH4USP28USP25BCL2A1ALDH1A1 | |
| SCHEMBL907759 | 0.78 | HRH4 (0.45) | HRH4BCL2A1ALDH1A1LMNAKIT | |
| SCHEMBL907761 | 0.78 | HRH4 (0.45) | HRH4BCL2A1ALDH1A1LMNAKIT |
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-3173411-A1 | TRPV1 ANTAGONISTS INCLUDING DIHYDROXY SUBSTITUENT AND USES THEREOF | Purdue Pharma L.P. (US) | 2017-05-31 | — | — | EP | disclosed |