Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGL | P06737 | 4/20 | 0.47 |
| ▸ | GPR183 | P32249 | 3/20 | 0.45 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.43 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.43 |
| ▸ | ITGAL | P20701 | 2/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2904446 | 1.00 | PYGL (0.47) | PYGLGPR183ITGB2ICAM1ITGAL | |
| SCHEMBL2897482 | 0.92 | GPR183 (0.52) | PYGLGPR183ITGB2ICAM1ITGAL | |
| SCHEMBL2897486 | 0.92 | GPR183 (0.52) | PYGLGPR183ITGB2ICAM1ITGAL | |
| SCHEMBL2897124 | 0.91 | GPR183 (0.52) | PYGLGPR183ITGB2ICAM1ITGAL | |
| SCHEMBL2897120 | 0.91 | GPR183 (0.52) | PYGLGPR183ITGB2ICAM1ITGAL | |
| SCHEMBL2897821 | 0.89 | PYGL (0.50) | PYGLGPR183ITGB2ICAM1ITGAL | |
| SCHEMBL2897817 | 0.89 | PYGL (0.50) | PYGLGPR183ITGB2ICAM1ITGAL | |
| SCHEMBL2903416 | 0.89 | CCR2 (0.47) | PYGL | |
| SCHEMBL2903419 | 0.89 | CCR2 (0.47) | PYGL | |
| SCHEMBL2905175 | 0.88 | PYGL (0.47) | PYGLGPR183ITGB2ICAM1ITGAL |
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-2010506-B1 | DIAZEPAN DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS | HOFFMANN LA ROCHE (CH) | 2010-08-04 | — | — | EP | disclosed |