Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHR1 | P34998 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 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 | |
|---|---|---|---|---|
| SCHEMBL3593105 | 1.00 | CRHR1 (0.41) | CRHR1HTTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3583250 | 0.87 | MEN1 (0.40) | HTTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3597235 | 0.80 | MEN1 (0.40) | HTTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3583746 | 0.79 | MEN1 (0.37) | HTTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3582084 | 0.79 | HTT (0.42) | HTTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL15182173 | 0.77 | CCR1 (0.38) | HTTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3591018 | 0.77 | HTT (0.37) | HTTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL13167966 | 0.76 | CYP2C19 (0.42) | HTTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL4441032 | 0.76 | DRD2 (0.41) | HTTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3590375 | 0.76 | HTT (0.38) | HTTCYP1A2CYP3A4CYP2C9CYP2C19 |
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-2121598-A2 | COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY | IRM LLC (BM) | 2009-11-25 | — | — | EP | claimed |
| WO-2008076754-A2 | COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY | IRM LLC (BM) | 2008-06-26 | — | — | WO | claimed |