Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | BRD2 | P25440 | 1/20 | 0.36 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 7/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL16951561 | 0.85 | HTT (0.42) | MEN1KMT2ATSHRALDH1A1HTT | |
| SCHEMBL16950354 | 0.85 | ACACB (0.35) | MAPTMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL16955449 | 0.83 | NQO1 (0.50) | NQO1MAPTTDP1TSHRALDH1A1 | |
| SCHEMBL16090021 | 0.81 | NQO1 (0.46) | NQO1MAPTTDP1MAPK1L3MBTL1 | |
| SCHEMBL12180749 | 0.81 | PTGS2 (0.46) | NQO1MAPTTDP1MAPK1L3MBTL1 | |
| SCHEMBL16955523 | 0.80 | ALDH1A1 (0.37) | MEN1KMT2AALDH1A1 | |
| SCHEMBL16961875 | 0.79 | NQO1 (0.39) | NQO1MAPTTDP1TSHRALDH1A1 | |
| SCHEMBL16951211 | 0.79 | NQO1 (0.41) | NQO1MAPTTDP1TSHRALDH1A1 | |
| SCHEMBL16960034 | 0.77 | NQO1 (0.36) | NQO1MAPTACACB | |
| SCHEMBL16960665 | 0.77 | GABRA1 (0.33) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |