Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 8/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MITF | O75030 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | STAT1 | P42224 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | TNIK | Q9UKE5 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL13891759 | 0.89 | TACR1 (0.37) | TACR1GRIN1GRIN2BROCK2ROCK1 | |
| SCHEMBL13891702 | 0.85 | KDM4E (0.41) | TACR1KDM4EMITFALDH1A1LMNA | |
| SCHEMBL5225857 | 0.84 | TACR1 (0.40) | TACR1KDM4EMITFALDH1A1LMNA | |
| SCHEMBL13891619 | 0.83 | MTOR (0.47) | TACR1ALDH1A1LMNAMEN1CYP1A2 | |
| SCHEMBL13891616 | 0.80 | SDHB (0.40) | TACR1ROCK2ROCK1TNIKPTGS2 | |
| SCHEMBL5528780 | 0.79 | TACR1 (0.38) | TACR1ROCK2ROCK1TNIKMEN1 | |
| SCHEMBL5532454 | 0.79 | TACR1 (0.41) | TACR1GRIN1GRIN2BROCK2ROCK1 | |
| SCHEMBL13891713 | 0.78 | TACR1 (0.42) | TACR1GRIN1GRIN2BROCK2ROCK1 | |
| SCHEMBL5527548 | 0.77 | ADRB2 (0.46) | TACR1GRIN1GRIN2BROCK2ROCK1 | |
| SCHEMBL5228204 | 0.76 | TACR1 (0.41) | TACR1ALDH1A1LMNASTAT3STAT1 |
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-1473295-B1 | FUSED BICYCLIC PYRIMIDINE DERIVATIVES | KYORIN SEIYAKU KK (JP) | 2009-04-01 | — | — | EP | disclosed |