Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | SOD1 | P00441 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 2/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25065886 | 0.76 | KDM4E (0.46) | XDHCES2SOD1MAPTKDM4E | |
| SCHEMBL20339421 | 0.74 | CES2 (0.35) | XDHCES2SOD1MAPTGAA | |
| SCHEMBL561801 | 0.74 | MAPT (0.47) | CES2SOD1MAPTGAAKDM4E | |
| SCHEMBL18711830 | 0.69 | PDE2A (0.39) | RAB9AHTTARDAO | |
| SCHEMBL2087491 | 0.68 | PARP1 (0.50) | MAPTRAB9A | |
| SCHEMBL30021526 | 0.65 | CYP1A2 (0.57) | XDHMAPTGAAKDM4EHTT | |
| SCHEMBL3558874 | 0.65 | KDM4E (0.50) | MAPTGAAKDM4ERAB9AHTT | |
| SCHEMBL14026646 | 0.65 | PARP1 (0.40) | XDHMAPTGAAKDM4ERAB9A | |
| SCHEMBL440959 | 0.63 | CES2 (0.58) | CES2MAPTHPGD | |
| SCHEMBL23689986 | 0.62 | DDR1 (0.40) | SOD1MAPTKDM4EARDAO |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5109004-A | Cyano phenyl-substituted with heterocylic compound; insecticides, miticides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-04-28 | — | — | US | disclosed |
| EP-0398499-A2 | Insecticides | ZENECA LIMITED (GB) | 1990-11-22 | — | — | EP | disclosed |