Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKLR | P30613 | 18/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28023214 | 0.79 | PKLR (0.46) | PKLR | |
| SCHEMBL1920680 | 0.78 | ALDH1A1 (0.49) | — | |
| SCHEMBL27991275 | 0.78 | PTPN11 (0.44) | — | |
| SCHEMBL16084000 | 0.78 | ALDH1A1 (0.57) | PKLR | |
| SCHEMBL16051041 | 0.76 | PKLR (0.58) | PKLR | |
| SCHEMBL28023812 | 0.76 | PKLR (0.52) | PKLRCYP2D6HSD17B10 | |
| SCHEMBL1921183 | 0.75 | HPGD (0.55) | — | |
| SCHEMBL1298628 | 0.75 | HPGD (0.59) | — | |
| SCHEMBL1298702 | 0.74 | POLB (0.54) | CYP2D6 | |
| SCHEMBL7002476 | 0.74 | HSP90AA1 (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105121425-A | Therapeutic compounds and compositions | AGIOS PHARMACEUTICALS INC | 2015-12-02 | — | — | CN | disclosed |