Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH2 | P25021 | 1/20 | 0.58 |
| ▸ | HRH1 | P35367 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | MC4R | P32245 | 1/20 | 0.52 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.51 |
| ▸ | ACE | P12821 | 1/20 | 0.51 |
| ▸ | P2RX7 | Q99572 | 6/20 | 0.50 |
| ▸ | CTSS | P25774 | 2/20 | 0.50 |
| ▸ | CTSL | P07711 | 1/20 | 0.50 |
| ▸ | CTSB | P07858 | 1/20 | 0.50 |
| ▸ | CTSK | P43235 | 1/20 | 0.50 |
| ▸ | UGCG | Q16739 | 1/20 | 0.49 |
| ▸ | MMP1 | P03956 | 1/20 | 0.49 |
| ▸ | MMP3 | P08254 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL15810045 | 1.00 | HRH2 (0.58) | HRH2HRH1KMT2AMAPK1CYP3A4 | |
| SCHEMBL5064576 | 1.00 | HRH2 (0.58) | HRH2HRH1KMT2AMAPK1CYP3A4 | |
| SCHEMBL1361202 | 0.95 | KMT2A (0.62) | HRH2HRH1KMT2AMAPK1CYP3A4 | |
| SCHEMBL15809950 | 0.95 | KMT2A (0.62) | HRH2HRH1KMT2AMAPK1CYP3A4 | |
| SCHEMBL15809917 | 0.89 | HRH2 (0.55) | HRH2HRH1KMT2AMAPK1CYP3A4 | |
| SCHEMBL15809918 | 0.89 | HRH2 (0.55) | HRH2HRH1KMT2AMAPK1CYP3A4 | |
| SCHEMBL15810040 | 0.89 | P2RX7 (0.60) | HRH2HRH1KMT2AMAPK1CYP3A4 | |
| SCHEMBL15810038 | 0.89 | P2RX7 (0.60) | HRH2HRH1KMT2AMAPK1CYP3A4 | |
| SCHEMBL4511308 | 0.88 | HRH2 (0.51) | HRH2HRH1KMT2AMAPK1MC4R | |
| SCHEMBL4510471 | 0.88 | MC4R (0.56) | HRH2HRH1KMT2AMAPK1MC4R |
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-2521715-B1 | PIPERAZINES AS ANTIMALARIAL AGENTS | ACTELION PHARMACEUTICALS LTD (CH) | 2014-06-25 | — | — | EP | disclosed |