Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 9/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.34 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.33 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.33 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14101987 | 0.91 | KCNK3 (0.34) | GRIN2BP2RX7KCNK3THRBGRIN1 | |
| SCHEMBL4720752 | 0.90 | LGALS3 (0.34) | GRIN2BP2RX7KCNK3 | |
| SCHEMBL4722667 | 0.81 | AR (0.34) | AKR1B1AKR1B10P2RX7 | |
| SCHEMBL4718895 | 0.78 | CYP3A4 (0.32) | — | |
| SCHEMBL4720926 | 0.77 | WDR5 (0.33) | AKR1B1PTGDR2AKR1B10 | |
| SCHEMBL4722852 | 0.77 | GRIN1 (0.34) | GRIN2BKCNK3GRIN1 | |
| SCHEMBL4724182 | 0.77 | P2RX7 (0.36) | P2RX7 | |
| SCHEMBL4718912 | 0.77 | P2RX7 (0.36) | P2RX7 | |
| SCHEMBL4718914 | 0.77 | P2RX7 (0.36) | P2RX7 | |
| SCHEMBL14101709 | 0.75 | F10 (0.39) | AKR1B10 |
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-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |