Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 4/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
| ▸ | ABL1 | P00519 | 3/20 | 0.35 |
| ▸ | BCR | P11274 | 3/20 | 0.35 |
| ▸ | TTR | P02766 | 3/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.35 |
| ▸ | NQO2 | P16083 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16951633 | 0.83 | ACACB (0.33) | MEN1MAPTKMT2A | |
| SCHEMBL16959735 | 0.83 | KDM4E (0.37) | PTGS2KDM4EESR1AHR | |
| SCHEMBL16960173 | 0.83 | GABRA1 (0.39) | ALOX5PTGS2MEN1NPC1PTGS1 | |
| SCHEMBL16951177 | 0.83 | CYP1A1 (0.39) | CYP1A1CYP1B1TAAR1ABL1BCR | |
| SCHEMBL16951999 | 0.82 | MEP1B (0.33) | — | |
| SCHEMBL171441 | 0.81 | ALDH1A1 (0.52) | CYP1A1CYP1B1TAAR1CYP19A1 | |
| SCHEMBL16953159 | 0.81 | LMNA (0.43) | TTRALOX5PTGS2KDM4EMEN1 | |
| SCHEMBL16961706 | 0.81 | CETP (0.33) | — | |
| SCHEMBL16951774 | 0.80 | CYP1A1 (0.43) | CYP1A1CYP1B1ABL1BCRTTR | |
| SCHEMBL16961378 | 0.80 | AHR (0.39) | ALOX5KDM4EHDAC6CYP1A2AHR |
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 |