Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DEGS1 | O15121 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | PARP1 | P09874 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | WNT3A | P56704 | 4/20 | 0.39 |
| ▸ | CDK9 | P50750 | 2/20 | 0.38 |
| ▸ | NPY2R | P49146 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | PHGDH | O43175 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19997367 | 0.88 | DEGS1 (0.41) | DEGS1ALDH1A1PARP1MEN1KMT2A | |
| SCHEMBL21935457 | 0.86 | KMT2A (0.46) | DEGS1ALDH1A1PARP1MEN1KMT2A | |
| SCHEMBL17626187 | 0.80 | RAB9A (0.53) | CYP1A2TRPA1 | |
| SCHEMBL17628656 | 0.73 | RAB9A (0.56) | KMT2ACYP1A2MAPTTRPA1 | |
| SCHEMBL21935377 | 0.72 | TRPA1 (0.55) | CYP1A2TSHRTRPA1 | |
| SCHEMBL21935664 | 0.71 | TRPA1 (0.52) | HSD17B10CYP1A2TRPA1 | |
| SCHEMBL17626308 | 0.71 | MAPK1 (0.59) | ALDH1A1KMT2ACYP1A2TSHRTRPA1 | |
| SCHEMBL17626184 | 0.70 | RAB9A (0.61) | DEGS1KMT2ACYP1A2TSHRTRPA1 | |
| SCHEMBL17626299 | 0.70 | PORCN (0.59) | ALDH1A1HSD17B10CYP1A2TRPA1 | |
| SCHEMBL29337979 | 0.70 | WNT3A (0.71) | WNT3A |
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-2999699-B1 | PURINE DIONES AS WNT PATHWAY MODULATORS | AGENCY SCIENCE TECH & RES (SG) | 2020-04-29 | — | — | EP | disclosed |