Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.43 |
| ▸ | SLC5A2 | P31639 | 4/20 | 0.41 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MGAT2 | Q10469 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.32 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.32 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9561365 | 0.81 | CYP1A2 (0.31) | CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9561359 | 0.81 | CYP1A2 (0.31) | CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9561250 | 0.77 | NQO1 (0.47) | SLC5A2SLC5A1CYP1A2L3MBTL1PDK2 | |
| SCHEMBL9637914 | 0.77 | NQO1 (0.47) | SLC5A2SLC5A1CYP1A2L3MBTL1PDK2 | |
| SCHEMBL22337091 | 0.68 | CYP1A2 (0.55) | KDM1ACYP1A2CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL21961560 | 0.68 | KDM1A (0.42) | KDM1ASLC5A2SLC5A1L3MBTL1TUBB1 | |
| SCHEMBL2173955 | 0.67 | SLC6A3 (0.38) | — | |
| SCHEMBL9484876 | 0.67 | L3MBTL1 (0.53) | KDM1AL3MBTL1TUBB1NAAA | |
| SCHEMBL1547577 | 0.67 | L3MBTL1 (0.53) | KDM1ACYP1A2CYP2C19L3MBTL1TUBB1 | |
| SCHEMBL21874044 | 0.66 | KDM1A (0.40) | KDM1ACYP1A2CYP2C9CYP2C19KCNQ3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5225607-A | Multistage etherification or dehydrohalogenation and reductive dechlorination | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-07-06 | — | — | US | disclosed |
| US-5196610-A | INSECTICIDAL ETHERS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-03-23 | — | — | US | disclosed |
| EP-0211561-B1 | INSECTICIDAL ETHERS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-03-11 | — | — | EP | disclosed |
| EP-0211561-A1 | Insecticidal ethers | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-02-25 | — | — | EP | disclosed |