Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 11/20 | 0.38 |
| ▸ | HTR2A | P28223 | 10/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 10/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.36 |
| ▸ | TERT | O14746 | 1/20 | 0.34 |
| ▸ | RHEB | Q15382 | 1/20 | 0.33 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7017882 | 0.82 | CYP1A2 (0.41) | SLC6A4HTR2ASLC6A2SLC6A3RHEB | |
| SCHEMBL10776395 | 0.79 | RHEB (0.39) | SLC6A4HTR2AKCNH2SLC6A2SLC6A3 | |
| SCHEMBL9686712 | 0.78 | KMO (0.39) | KMOHSP90AA1SLC6A4HTR2AKCNH2 | |
| SCHEMBL10767954 | 0.72 | DPP4 (0.34) | SLC6A4SLC6A2SLC6A3RHEB | |
| SCHEMBL6776995 | 0.72 | COMT (0.40) | — | |
| SCHEMBL10390673 | 0.70 | LTA4H (0.41) | SCN9ACHEK2CYP2C19 | |
| SCHEMBL28110756 | 0.69 | HTR2A (0.47) | HSP90AA1SLC6A4HTR2AKCNH2SLC6A2 | |
| SCHEMBL9775712 | 0.68 | AR (0.44) | SLC6A4SLC6A2SLC6A3CYP2C19 | |
| SCHEMBL30543010 | 0.67 | TERT (0.53) | SLC6A4SLC6A2SLC6A3TERTRHEB | |
| SCHEMBL7007179 | 0.67 | MAPT (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0288810-B1 | HETEROCYCLIC NEOPHANE ANALOGS, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS PESTICIDES | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-12-02 | — | — | EP | disclosed |