Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | MAPK10 | P53779 | 6/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | LIPE | Q05469 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20471175 | 0.88 | ALDH1A1 (0.39) | ALDH1A1KDM4EMAPK10L3MBTL1POLB | |
| SCHEMBL21459364 | 0.77 | MAPT (0.43) | ALDH1A1L3MBTL1GAANPSR1MEN1 | |
| SCHEMBL29863514 | 0.77 | MAPT (0.43) | ALDH1A1L3MBTL1GAANPSR1MEN1 | |
| SCHEMBL21598903 | 0.75 | PIK3R1 (0.37) | — | |
| SCHEMBL18529455 | 0.74 | KDM4E (0.38) | ALDH1A1KDM4EL3MBTL1LIPENPSR1 | |
| SCHEMBL18529459 | 0.74 | KDM4E (0.50) | ALDH1A1KDM4EMAPK10LIPEGAA | |
| SCHEMBL18529461 | 0.73 | MEN1 (0.55) | ALDH1A1KDM4EMAPK10LIPEGAA | |
| SCHEMBL18535700 | 0.72 | POLQ (0.46) | KDM4ECYP1A2CYP2C19 | |
| SCHEMBL875436 | 0.72 | POLB (0.44) | ALDH1A1KDM4EMAPK10L3MBTL1POLB | |
| SCHEMBL19994240 | 0.69 | MEN1 (0.42) | ALDH1A1KDM4EL3MBTL1LIPEMEN1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3519389-A1 | NOVEL 5-SUBSTITUTED IMIDAZOLYLMETHYL DERIVATIVES | Bayer CropScience Aktiengesellschaft (DE) | 2019-08-07 | — | — | EP | disclosed |
| WO-2018145921-A1 | COMPOSITION FOR CONTROLLING HARMFUL MICROORGANISMS COMPRISING 1 -(PHENOXY-PYRIDINYL)-2-(1,2,4-TRIAZOL-1 -YL)-ETHANOL DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2018-08-16 | — | — | WO | disclosed |
| WO-2018145933-A1 | TRIAZOLETHIONE DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2018-08-16 | — | — | WO | disclosed |
| EP-3334718-A1 | TRIAZOLE DERIVATIVES, INTERMEDIATES THEREOF AND THEIR USE AS FUNGICIDES | Bayer CropScience Aktiengesellschaft (DE) | 2018-06-20 | — | — | EP | disclosed |
| WO-2018060091-A1 | NOVEL 5-SUBSTITUTED IMIDAZOLYLMETHYL DERIVATIVES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2018-04-05 | — | — | WO | disclosed |
| WO-2017029179-A1 | TRIAZOLE DERIVATIVES, INTERMEDIATES THEREOF AND THEIR USE AS FUNGICIDES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2017-02-23 | — | — | WO | disclosed |