Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | TYR | P14679 | 5/20 | 0.41 |
| ▸ | MAOA | P21397 | 4/20 | 0.40 |
| ▸ | MAOB | P27338 | 4/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 3/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.39 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4735618 | 0.83 | — | — | |
| SCHEMBL2456367 | 0.76 | PTPRC (0.38) | CA12CA9MAPTMEN1HTT | |
| SCHEMBL14435757 | 0.76 | CYP3A4 (0.48) | CYP3A4TYRMAOAMAOBCA12 | |
| SCHEMBL18417129 | 0.76 | AHR (0.54) | CYP3A4TYRMAOAMAOBCA12 | |
| SCHEMBL14259795 | 0.75 | MAOA (0.49) | TYRMAOAMAOBMCL1CISD1 | |
| SCHEMBL9874879 | 0.73 | MAOB (0.40) | MAOAMAOBCA9HTTKDM4E | |
| SCHEMBL5711966 | 0.73 | MAPT (0.42) | CYP3A4CA12CA9MAPTMEN1 | |
| SCHEMBL8760917 | 0.72 | AHR (0.31) | CYP3A4MAPTMEN1HPGDCYP2C19 | |
| SCHEMBL10448868 | 0.71 | AHR (0.74) | CYP3A4MAPTMEN1HPGDHTT | |
| SCHEMBL10448864 | 0.71 | AHR (0.74) | CYP3A4MAPTMEN1HPGDHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1304924-A2 | COMPOSITIONS FOR REPELLING CRAWLING INSECTS | Bayer Aktiengesellschaft (DE) | 2003-05-02 | — | — | EP | disclosed |
| WO-2002005646-A2 | COMPOSITIONS FOR REPELLING CRAWLING INSECTS | S.C. JOHNSON & SON, INC. (US) (US) | 2002-01-24 | — | — | WO | disclosed |