Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 6/20 | 0.64 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 5/20 | 0.36 |
| ▸ | IDO1 | P14902 | 2/20 | 0.34 |
| ▸ | TDO2 | P48775 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL1457324 | 1.00 | MIF (0.64) | MIFTRPA1TRPV1HSD11B1IDO1 | |
| SCHEMBL8762285 | 0.89 | MIF (0.78) | MIFTRPA1TRPV1 | |
| SCHEMBL20181382 | 0.79 | MIF (0.53) | MIFTRPA1TRPV1 | |
| SCHEMBL2477922 | 0.79 | MIF (0.39) | MIFHSD11B1IDO1TDO2DAO | |
| SCHEMBL21406285 | 0.79 | MIF (0.53) | MIFTRPA1TRPV1 | |
| SCHEMBL14861683 | 0.79 | MIF (0.39) | MIFHSD11B1IDO1TDO2DAO | |
| SCHEMBL20181383 | 0.79 | MIF (0.53) | MIFTRPA1TRPV1 | |
| SCHEMBL16034537 | 0.79 | MIF (0.39) | MIFHSD11B1IDO1TDO2DAO | |
| 1-Phenylethyl Isothiocyanate SCHEMBL3795180 | 0.78 | MIF (1.00) | MIFTRPA1TRPV1 | |
| 1-Phenylethyl Isothiocyanate SCHEMBL3792824 | 0.78 | MIF (1.00) | MIFTRPA1TRPV1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009040008-A1 | NOVEL IMINOOXAZOLE AND IMINOTHIAZOLE COMPOUNDS | BAYER CROPSCIENCE AG (DE) | 2009-04-02 | — | — | WO | disclosed |
| EP-2042492-A1 | Novel Iminooxazole and Iminothiazole Compounds | Bayer CropScience AG (DE) | 2009-04-01 | — | — | EP | disclosed |
| EP-2042492-A1 | Novel Iminooxazole and Iminothiazole Compounds | Bayer CropScience AG (DE) | 2009-04-01 | — | — | EP | disclosed |
| EP-1992228-A1 | Insecticidal substituted thiourea derivatives | Bayer CropScience AG (DE) | 2008-11-19 | — | — | EP | disclosed |
| EP-1992228-A1 | Insecticidal substituted thiourea derivatives | Bayer CropScience AG (DE) | 2008-11-19 | — | — | EP | disclosed |