Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.37 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | AIMP2 | Q13155 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.35 |
| ▸ | SMYD2 | Q9NRG4 | 1/20 | 0.35 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.34 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20042673 | 0.92 | MAPK1 (0.38) | PTGDR2AIMP2 | |
| SCHEMBL20042830 | 0.89 | ME2 (0.43) | KMT2AGPBAR1FKBP1A | |
| SCHEMBL20042750 | 0.87 | F2 (0.39) | KMT2AKCNQ2 | |
| SCHEMBL20042888 | 0.85 | PTGDR2 (0.35) | PTGDR2GPBAR1 | |
| SCHEMBL20042703 | 0.85 | PTGDR2 (0.37) | GRIN2BPTGDR2 | |
| SCHEMBL20042748 | 0.85 | NPC1 (0.49) | KMT2AGPBAR1FKBP1A | |
| SCHEMBL20042690 | 0.84 | GFER (0.41) | KMT2AGPBAR1 | |
| SCHEMBL20042886 | 0.81 | HPGD (0.49) | KMT2A | |
| SCHEMBL20042688 | 0.80 | C3AR1 (0.45) | PTGDR2KMT2A | |
| SCHEMBL20042887 | 0.76 | GPR6 (0.42) | — |
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 |