Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | HRH2 | P25021 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.37 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1751840 | 0.85 | KCNH2 (0.43) | KCNH2HRH3TBXAS1TDP1L3MBTL1 | |
| SCHEMBL9212796 | 0.85 | PIK3CA (0.44) | KCNH2HRH3TBXAS1TDP1L3MBTL1 | |
| SCHEMBL15004677 | 0.82 | KCNH2 (0.42) | KCNH2HRH3TBXAS1TDP1L3MBTL1 | |
| Pirodavir SCHEMBL146440 | 0.80 | HRH3 (0.46) | KCNH2HRH3TBXAS1TDP1L3MBTL1 | |
| SCHEMBL9381746 | 0.78 | KCNH2 (0.44) | KCNH2HRH3TBXAS1TDP1L3MBTL1 | |
| SCHEMBL9381992 | 0.78 | KCNH2 (0.50) | KCNH2HRH3TBXAS1TDP1L3MBTL1 | |
| SCHEMBL9218863 | 0.78 | HRH3 (0.44) | KCNH2HRH3TBXAS1TDP1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL9379751 | 0.78 | KCNH2 (0.44) | KCNH2HRH3TBXAS1TDP1L3MBTL1 | |
| SCHEMBL9379884 | 0.78 | KCNH2 (0.44) | KCNH2HRH3TBXAS1TDP1L3MBTL1 | |
| SCHEMBL9209752 | 0.78 | HRH3 (0.44) | KCNH2HRH3TBXAS1TDP1L3MBTL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0320032-B1 | Pyridizinamine derivatives | JANSSEN PHARMACEUTICA NV (BE) | 1995-01-18 | — | — | EP | disclosed |
| US-5231184-A | Viricide intermediate | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-07-27 | — | — | US | disclosed |
| US-5106973-A | Viricide intermediates | JANSSEN PHARMACEUTICA N.V. (BE) | 1992-04-21 | — | — | US | disclosed |
| US-4992433-A | Viricides | JANSSEN PHARMACEUTICA N.V. (BE) | 1991-02-12 | — | — | US | disclosed |