Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 14/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 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 | |
|---|---|---|---|---|
| SCHEMBL20042888 | 0.92 | PTGDR2 (0.35) | PTGDR2CYP1A2CHRM4 | |
| SCHEMBL20042673 | 0.91 | MAPK1 (0.38) | PTGDR2 | |
| SCHEMBL20042830 | 0.86 | ME2 (0.43) | — | |
| SCHEMBL20042747 | 0.85 | GRIN1 (0.39) | PTGDR2GRIN2B | |
| SCHEMBL20042750 | 0.85 | F2 (0.39) | — | |
| SCHEMBL20042748 | 0.84 | NPC1 (0.49) | — | |
| SCHEMBL20042690 | 0.83 | GFER (0.41) | CHRM4 | |
| SCHEMBL20042836 | 0.81 | P2RX7 (0.43) | — | |
| SCHEMBL20042688 | 0.80 | C3AR1 (0.45) | PTGDR2CYP1A2CHRM4 | |
| SCHEMBL20042666 | 0.76 | KMT2A (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018066718-A1 | THERAPEUTIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-04-12 | — | — | WO | disclosed |