Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA4 | P22748 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
| ▸ | MLNR | O43193 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | DPP4 | P27487 | 1/20 | 0.43 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.43 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4698703 | 1.00 | KDM4E (0.47) | KDM4ECA1CA2CA4CA9 | |
| SCHEMBL4697177 | 1.00 | KDM4E (0.47) | KDM4ECA1CA2CA4CA9 | |
| SCHEMBL4470422 | 0.91 | CA1 (0.48) | CA1CA2CA4CA9CNR2 | |
| SCHEMBL4466254 | 0.91 | CA1 (0.48) | CA1CA2CA4CA9CNR2 | |
| SCHEMBL4466251 | 0.91 | CA1 (0.48) | CA1CA2CA4CA9CNR2 | |
| SCHEMBL4697532 | 0.90 | CNR2 (0.51) | KDM4ECA1CA2CA4CA9 | |
| SCHEMBL4697529 | 0.90 | CNR2 (0.51) | KDM4ECA1CA2CA4CA9 | |
| SCHEMBL4467575 | 0.87 | CA1 (0.50) | CA1CA2CA4CA9CNR2 | |
| SCHEMBL4468592 | 0.87 | CA1 (0.50) | CA1CA2CA4CA9CNR2 | |
| SCHEMBL13708853 | 0.84 | CA1 (0.48) | CA1CA2CA4CA9CNR2 |
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-1966132-A2 | COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-09-10 | — | — | EP | disclosed |
| WO-2007070760-A2 | COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-06-21 | — | — | WO | disclosed |