Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.53 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.53 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | CTSG | P08311 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA7 | P43166 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.34 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.34 |
| ▸ | BID | P55957 | 3/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.33 |
| ▸ | BAK1 | Q16611 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL5743029 | 0.83 | GABRA1 (0.53) | GABRA1GABRB2ELANECTSGCA12 | |
| SCHEMBL5744962 | 0.81 | BID (0.42) | GABRA1GABRB2BIDMCL1BCL2L1 | |
| SCHEMBL20806632 | 0.78 | GABRA1 (0.43) | GABRA1GABRB2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL4963083 | 0.77 | BID (0.55) | GABRA1GABRB2CA12CA1CA2 | |
| SCHEMBL5742072 | 0.77 | BID (0.47) | ELANECTSGCA12CA1CA2 | |
| SCHEMBL6675604 | 0.74 | GABRA1 (0.61) | GABRA1GABRB2ELANECTSGPOLB | |
| SCHEMBL1053654 | 0.74 | GABRA1 (0.79) | GABRA1GABRB2ELANECTSGCA1 | |
| SCHEMBL11393106 | 0.73 | BID (0.63) | BIDMCL1BCL2L1BAK1 | |
| SCHEMBL108067 | 0.73 | GABRA1 (0.64) | GABRA1GABRB2ELANECTSGCA12 | |
| SCHEMBL258656 | 0.72 | GABRA1 (0.63) | GABRA1GABRB2ELANECTSGPOLB |
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-1678146-A1 | PYRIMIDINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | Pharmacia Corporation (US) | 2006-07-12 | — | — | EP | disclosed |
| WO-2005040133-A1 | PYRIMIDINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | PHARMACIA CORPORATION (US) | 2005-05-06 | — | — | WO | disclosed |