Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 13/20 | 0.46 |
| ▸ | MIF | P14174 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2671847 | 0.84 | MAPT (0.50) | CTSKMIFRAB9ANPC1RECQL | |
| SCHEMBL1783780 | 0.84 | MAPT (0.50) | CTSKMIFRAB9ANPC1RECQL | |
| SCHEMBL8829337 | 0.75 | CTSK (0.45) | CTSKMIFRAB9ANPC1RECQL | |
| SCHEMBL5544738 | 0.75 | CTSK (0.45) | CTSKMIFRAB9ANPC1RECQL | |
| SCHEMBL8829341 | 0.75 | CTSK (0.45) | CTSKMIFRAB9ANPC1RECQL | |
| SCHEMBL12731332 | 0.74 | RAB9A (0.49) | CTSKMIFRAB9ANPC1RECQL | |
| SCHEMBL2943324 | 0.74 | MIF (0.53) | CTSKMIFRAB9ANPC1RECQL | |
| SCHEMBL2943326 | 0.74 | MIF (0.53) | CTSKMIFRAB9ANPC1RECQL | |
| SCHEMBL28754336 | 0.73 | CA12 (0.40) | CTSK | |
| SCHEMBL3389357 | 0.73 | DGAT1 (0.32) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1675858-A2 | 5-ARYL-PYRAZOLO [4,3-D] PYRIMIDINES, PYRIDINES, AND PYRAZINES AND RELATED COMPOUNDS | NEUROGEN CORPORATION (US) | 2006-07-05 | — | — | EP | disclosed |
| WO-2005028480-A2 | 5-ARYL-PYRAZOLO[4,3-D]PYRIMIDINES, PYRIDINES, AND PYRAZINES AND RELATED COMPOUNDS | NEUROGEN CORPORATION (US) | 2005-03-31 | — | — | WO | disclosed |