Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 2/20 | 0.43 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14200252 | 0.91 | BCHE (0.45) | CNR2BCHENAAASIGMAR1 | |
| SCHEMBL14354706 | 0.89 | CNR2 (0.53) | CNR2BCHENAAAL3MBTL1CA12 | |
| SCHEMBL14230104 | 0.85 | BCHE (0.55) | CNR2BCHENAAAL3MBTL1CA12 | |
| SCHEMBL15254560 | 0.80 | L3MBTL1 (0.50) | CNR2BCHEL3MBTL1CA12CA1 | |
| SCHEMBL15254338 | 0.80 | L3MBTL1 (0.50) | CNR2BCHEL3MBTL1CA12CA1 | |
| SCHEMBL15254340 | 0.80 | L3MBTL1 (0.50) | CNR2BCHEL3MBTL1CA12CA1 | |
| SCHEMBL14200251 | 0.79 | SIGMAR1 (0.40) | BCHECA12CA1CA9SIGMAR1 | |
| SCHEMBL14200249 | 0.78 | NAAA (0.46) | CNR2BCHENAAACA12CA1 | |
| SCHEMBL13676231 | 0.78 | BCHE (0.53) | CNR2BCHENAAAL3MBTL1CA12 | |
| SCHEMBL3483282 | 0.78 | CNR2 (0.47) | CNR2BCHENAAAL3MBTL1CA12 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |
| US-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |