Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.39 |
| ▸ | TGM2 | P21980 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.33 |
| ▸ | CFTR | P13569 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | PDE2A | O00408 | 2/20 | 0.33 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.33 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.33 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.32 |
| ▸ | KRAS | P01116 | 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 | |
|---|---|---|---|---|
| SCHEMBL28987801 | 0.81 | CES2 (0.42) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL16960591 | 0.80 | CES2 (0.44) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL16950454 | 0.80 | JAK2 (0.43) | CES2ALDH1A1GAAPDE2A | |
| SCHEMBL16956845 | 0.80 | CES2 (0.39) | CES2TGM2KDM4EALDH1A1HPGD | |
| SCHEMBL16956625 | 0.78 | CES2 (0.40) | CES2TGM2KDM4EALDH1A1HPGD | |
| SCHEMBL16950532 | 0.77 | CES2 (0.34) | CES2TGM2 | |
| SCHEMBL16960167 | 0.76 | AR (0.46) | CES2KDM4EALDH1A1CYP2C19NOTUM | |
| SCHEMBL16957162 | 0.76 | TGM2 (0.36) | TGM2KDM4EALDH1A1GAA | |
| SCHEMBL16962095 | 0.75 | TP53 (0.35) | TGM2HPGDCYP2C19 | |
| SCHEMBL16962221 | 0.75 | PPARG (0.36) | CES2TGM2KDM4EALDH1A1HPGD |
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 |