Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | BRD2 | P25440 | 2/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 3/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.33 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.33 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.33 |
| ▸ | F7 | P08709 | 1/20 | 0.33 |
| ▸ | F3 | P13726 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16956509 | 0.86 | MAPT (0.34) | MAPTALDH1A1MEN1KMT2AHTT | |
| SCHEMBL16954575 | 0.85 | PTGS2 (0.39) | PTGS2MAPTTDP1MAPK1L3MBTL1 | |
| SCHEMBL16961715 | 0.84 | KMT2A (0.43) | PTGS2TDP1MAPK1L3MBTL1BRD4 | |
| SCHEMBL16955483 | 0.83 | ABCB11 (0.36) | ALDH1A1MEN1KMT2AHTTKDM4E | |
| SCHEMBL16957056 | 0.81 | MEN1 (0.37) | PTGS2MAPTBRD4BRD2CREBBP | |
| SCHEMBL16953048 | 0.80 | GABRA1 (0.34) | HTTKDM4E | |
| SCHEMBL16961473 | 0.79 | CYP4F2 (0.40) | MAPTMAPK1ALDH1A1MEN1KMT2A | |
| SCHEMBL12180749 | 0.78 | PTGS2 (0.46) | PTGS2MAPTTDP1MAPK1L3MBTL1 | |
| SCHEMBL16090021 | 0.78 | NQO1 (0.46) | PTGS2MAPTTDP1MAPK1L3MBTL1 | |
| SCHEMBL16960023 | 0.78 | ALDH1A1 (0.38) | PTGS2BRD4BRD2CREBBPALDH1A1 |
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 |