Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 5/20 | 0.45 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | TDO2 | P48775 | 1/20 | 0.44 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | CCR1 | P32246 | 1/20 | 0.37 |
| ▸ | PDE2A | O00408 | 2/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | ACP3 | P15309 | 1/20 | 0.34 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.34 |
| ▸ | MPL | P40238 | 1/20 | 0.33 |
| ▸ | KRAS | P01116 | 2/20 | 0.33 |
| ▸ | SOS1 | Q07889 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8427460 | 0.84 | ACP3 (0.44) | CTSSP2RX7CTSKACP3 | |
| SCHEMBL12009462 | 0.80 | P2RX7 (0.50) | CTSSIDO1TDO2P2RX7EPHX2 | |
| SCHEMBL20551075 | 0.79 | IDO1 (0.44) | CTSSIDO1TDO2P2RX7EPHX2 | |
| SCHEMBL4550765 | 0.77 | IDO1 (0.51) | CTSSIDO1TDO2P2RX7EPHX2 | |
| SCHEMBL21132890 | 0.77 | IDO1 (0.47) | CTSSIDO1TDO2P2RX7EPHX2 | |
| SCHEMBL25019477 | 0.77 | IDO1 (0.47) | CTSSIDO1TDO2P2RX7EPHX2 | |
| SCHEMBL4234796 | 0.77 | IDO1 (0.51) | CTSSIDO1TDO2P2RX7EPHX2 | |
| SCHEMBL24988934 | 0.77 | IDO1 (0.47) | CTSSIDO1TDO2P2RX7EPHX2 | |
| SCHEMBL13328616 | 0.77 | IDO1 (0.47) | CTSSIDO1TDO2P2RX7EPHX2 | |
| SCHEMBL14120782 | 0.77 | IDO1 (0.51) | CTSSIDO1TDO2P2RX7EPHX2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100395234-C | Novel CB1 receptor inverse agonists | HOFFMANN LA ROCHE (CH) | 2008-06-18 | — | — | CN | disclosed |
| CN-101012193-A | Novel CB 1 receptour inverse agonists | HOFFMANN LA ROCHE (CH) | 2007-08-08 | — | — | CN | disclosed |
| CN-1735593-A | Novel CB1 receptor inverse agonists | HOFFMANN LA ROCHE (CH) | 2006-02-15 | — | — | CN | disclosed |