Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 3/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.32 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.30 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.30 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.30 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12369610 | 0.78 | CHRNB2 (0.44) | CHRNB2CHRNB4CHRNA3CHRNA4HCAR2 | |
| SCHEMBL21848980 | 0.74 | CYP11B2 (0.35) | CYP1A2CYP2C9CYP11B1CYP11B2 | |
| SCHEMBL21233113 | 0.72 | CYP2E1 (0.38) | CHRNB2CHRNB4CHRNA3CHRNA4HCAR2 | |
| SCHEMBL29176201 | 0.72 | CYP1A2 (0.30) | CYP1A2CYP2C9 | |
| SCHEMBL30811735 | 0.72 | CYP1A2 (0.30) | CYP1A2CYP2C9 | |
| SCHEMBL17858623 | 0.72 | NOTUM (0.67) | RXRAGRIN1GRIN2BNOTUM | |
| SCHEMBL22952499 | 0.71 | CYP2E1 (0.37) | CHRNB2CHRNB4CHRNA3CHRNA4RXRA | |
| SCHEMBL20153304 | 0.70 | CHRNB2 (0.40) | CHRNB2CHRNB4CHRNA3CHRNA4HCAR2 | |
| SCHEMBL10053917 | 0.70 | HSP90AA1 (0.47) | CYP1A2CYP2C9GABRG2GABRB3GABRA5 | |
| SCHEMBL14022007 | 0.70 | CHRNB2 (0.40) | CHRNB2CHRNB4CHRNA3CHRNA4HCAR2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020065614-A1 | MONOACYLGLYCEROL LIPASE MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2020-04-02 | — | — | WO | disclosed |