Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.41 |
| ▸ | FEN1 | P39748 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | FLT1 | P17948 | 1/20 | 0.40 |
| ▸ | FLT4 | P35916 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7983810 | 0.89 | PARP1 (0.47) | ALDH1A1MAPTHPGDPARP1NPSR1 | |
| SCHEMBL7989108 | 0.84 | L3MBTL1 (0.48) | ALDH1A1MAPTHPGDPARP1MEN1 | |
| SCHEMBL7983792 | 0.82 | CES2 (0.46) | ALDH1A1MAPTHPGDPARP1NPSR1 | |
| SCHEMBL7973489 | 0.81 | KDM4E (0.41) | ALDH1A1MAPTNPSR1KMT2AGAA | |
| SCHEMBL7987660 | 0.81 | PARP1 (0.52) | ALDH1A1MAPTHPGDPARP1NPSR1 | |
| SCHEMBL7973495 | 0.81 | NPSR1 (0.46) | ALDH1A1HPGDNPSR1SMN1; SMN2GAA | |
| SCHEMBL7987781 | 0.79 | KAT6A (0.48) | ALDH1A1MAPTHPGDNPSR1MEN1 | |
| SCHEMBL7983751 | 0.78 | KAT6A (0.45) | ALDH1A1MEN1KMT2ASMN1; SMN2GAA | |
| SCHEMBL7991794 | 0.73 | FLT1 (0.57) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL7990928 | 0.73 | HPGD (0.44) | ALDH1A1HPGDERCC5FEN1SMN1; SMN2 |
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 |