Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | PLK1 | P53350 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | NQO1 | P15559 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.47 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7985087 | 0.88 | PARP10 (0.54) | PARP10NPC1PLK1NPSR1PLA2G4B | |
| SCHEMBL7985774 | 0.87 | TSHR (0.55) | PLA2G4BKMT2AALDH1A1RAB9AHPGD | |
| SCHEMBL7984806 | 0.84 | PARP10 (0.50) | PARP10NPC1PLK1NPSR1PLA2G4B | |
| SCHEMBL7985855 | 0.81 | KAT6A (0.52) | NPC1NPSR1KMT2AALDH1A1RAB9A | |
| SCHEMBL7985090 | 0.80 | CES2 (0.55) | PARP10PLK1NPSR1KMT2AALDH1A1 | |
| SCHEMBL13945433 | 0.80 | PARP10 (0.61) | PARP10NPC1PLK1NPSR1PLA2G4B | |
| SCHEMBL7973336 | 0.77 | ALDH1A1 (0.53) | NPC1PLK1KMT2AALDH1A1HPGD | |
| SCHEMBL7990723 | 0.76 | KMT2A (0.58) | PARP10NPC1NPSR1KMT2AALDH1A1 | |
| SCHEMBL4248781 | 0.76 | PARP10 (0.56) | PARP10NPC1PLK1NPSR1PLA2G4B | |
| SCHEMBL1979910 | 0.76 | PARP10 (0.66) | PARP10NPC1PLK1NPSR1PLA2G4B |
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 |
|---|---|---|---|---|---|---|---|
| US-6331628-B1 | REACTING A SUBSTITUTED HALOBENZENE WITH POTASSIUM, SODIUM AND/OR ZINC CYANIDE IN THE PRESENCE OF A METALLIC CATALYST | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2001-12-18 | — | — | US | disclosed |