Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 1/20 | 0.65 |
| ▸ | NPC1 | O15118 | 4/20 | 0.59 |
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.55 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.55 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.52 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL679991 | 0.95 | PLK1 (0.59) | PLK1NPC1RAB9ANPSR1HPGD | |
| SCHEMBL7985776 | 0.87 | MMP1 (0.61) | PLK1NPC1RAB9ASCN3ALMNA | |
| SCHEMBL17154224 | 0.87 | PLK1 (0.67) | PLK1NPC1RAB9ANPSR1HPGD | |
| SCHEMBL7985089 | 0.87 | PLK1 (0.65) | PLK1NPC1RAB9ANPSR1HPGD | |
| SCHEMBL679983 | 0.85 | ACACB (0.50) | PLK1NPC1RAB9ASCN3ALMNA | |
| SCHEMBL680509 | 0.83 | SCN3A (0.50) | PLK1NPC1RAB9AHPGDSCN3A | |
| SCHEMBL7984812 | 0.83 | PLK1 (0.59) | PLK1NPC1RAB9ANPSR1HPGD | |
| SCHEMBL14880157 | 0.82 | PLK1 (0.73) | PLK1NPC1RAB9ANPSR1HPGD | |
| SCHEMBL364340 | 0.82 | RXRA (0.62) | NPC1RAB9ASCN3AALDH1A1PARP10 | |
| SCHEMBL7985860 | 0.81 | KAT6A (0.61) | NPC1RAB9ANPSR1HPGDSCN3A |
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 |