Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL16951242 | 0.84 | KDM4E (0.38) | KMT2AALDH1A1CYP3A4HPGDMTNR1A | |
| SCHEMBL16957894 | 0.82 | PTGDR2 (0.40) | PTGDR2MEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL16951336 | 0.80 | TP53 (0.35) | PTGDR2HTR2CCHRNB2CHRNA4 | |
| SCHEMBL16954789 | 0.78 | OPRL1 (0.36) | PTGDR2CHRNB2CHRNA4 | |
| SCHEMBL16953955 | 0.78 | OPRL1 (0.36) | CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL16952965 | 0.78 | KRAS (0.34) | PTGDR2MEN1KMT2AHPGDMAPT | |
| SCHEMBL16955249 | 0.77 | PTGDR2 (0.40) | PTGDR2MEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL12047054 | 0.76 | SMN1; SMN2 (0.53) | PTGDR2MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL16961779 | 0.76 | TDP1 (0.35) | MEN1KMT2AHTR2CNPSR1 | |
| SCHEMBL16952190 | 0.76 | MAPT (0.53) | MEN1KMT2AALDH1A1HPGDMAPT |
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 |