Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 2/20 | 0.31 |
| ▸ | NOS1 | P29475 | 2/20 | 0.31 |
| ▸ | NOS2 | P35228 | 2/20 | 0.31 |
| ▸ | CES2 | O00748 | 2/20 | 0.31 |
| ▸ | CES1 | P23141 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9864434 | 1.00 | MEN1 (0.35) | MEN1KMT2ACA1CA2ALDH1A1 | |
| SCHEMBL10741893 | 0.83 | ALDH1A1 (0.42) | MEN1KMT2AALDH1A1MAPTCYP1A2 | |
| SCHEMBL10741896 | 0.83 | ALDH1A1 (0.42) | MEN1KMT2AALDH1A1MAPTCYP1A2 | |
| SCHEMBL9876616 | 0.83 | HDAC3 (0.37) | MEN1KMT2AMAPTNPC1 | |
| SCHEMBL9876619 | 0.83 | HDAC3 (0.37) | MEN1KMT2AMAPTNPC1 | |
| SCHEMBL9864882 | 0.78 | MEN1 (0.39) | MEN1KMT2ACA1CA2ALDH1A1 | |
| SCHEMBL11682859 | 0.75 | NOS3 (0.41) | MEN1KMT2ACA1CA2ALDH1A1 | |
| SCHEMBL11682857 | 0.75 | NOS3 (0.41) | MEN1KMT2ACA1CA2ALDH1A1 | |
| SCHEMBL9865245 | 0.73 | HDAC3 (0.38) | ALDH1A1IDO1NOS3NOS1NOS2 | |
| SCHEMBL9865237 | 0.73 | HDAC3 (0.38) | ALDH1A1IDO1NOS3NOS1NOS2 |
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-4994485-A | Seed and soil fungi, bacteria | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1991-02-19 | — | — | US | disclosed |
| EP-0234622-A1 | New thio compounds having fungicidal activity | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1987-09-02 | — | — | EP | disclosed |