Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIT | P10721 | 1/20 | 0.47 |
| ▸ | JAK3 | P52333 | 4/20 | 0.43 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.39 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.39 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 4/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.39 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.39 |
| ▸ | ATR | Q13535 | 1/20 | 0.38 |
| ▸ | ATRIP | Q8WXE1 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.38 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.38 |
| ▸ | DOT1L | Q8TEK3 | 2/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 2/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6638364 | 0.80 | HTR2C (0.59) | HTR2CHRH4ROCK2ADRB1HTR6 | |
| Hydrochloric Acid SCHEMBL6643702 | 0.79 | HTR2C (0.57) | HTR2CHRH4ROCK2ADRB1HTR6 | |
| SCHEMBL20157192 | 0.78 | KIT (0.42) | KITJAK3MAPK13MAPK12MAPK11 | |
| SCHEMBL20157193 | 0.78 | KIT (0.42) | KITJAK3MAPK13MAPK12MAPK11 | |
| SCHEMBL6271843 | 0.77 | HTR2C (0.65) | KITHTR2CHRH4PRKCQPRKCD | |
| SCHEMBL6281370 | 0.77 | HTR2C (0.65) | KITHTR2CHRH4PRKCQPRKCD | |
| SCHEMBL3690829 | 0.76 | HTR2C (0.66) | KITMAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL18437145 | 0.76 | HRH4 (0.55) | JAK3HRH4ROCK2HTR6 | |
| SCHEMBL30146614 | 0.75 | ADRB1 (0.64) | HTR2CADRB1HTR6 | |
| SCHEMBL3678498 | 0.75 | HTR2C (0.67) | KITHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005121094-A1 | PIPERAZINE AND PIPERIDINE DERIVATIVES AS ANTI-HIV-AGENTS | PFIZER LIMITED (GB) | 2005-12-22 | — | — | WO | disclosed |