Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | HTR3A | P46098 | 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 | |
|---|---|---|---|---|
| SCHEMBL29825825 | 0.76 | GRM5 (0.40) | CYP1A2CYP3A4 | |
| SCHEMBL4853165 | 0.75 | PIM1 (0.46) | HTR2C | |
| SCHEMBL29825931 | 0.71 | HRH1 (0.43) | HTR2CHTR1A | |
| SCHEMBL30740685 | 0.71 | GBA1 (0.43) | HTR2C | |
| SCHEMBL30740728 | 0.70 | CYP1A2 (0.35) | CYP1A2CYP3A4HTR1ACYP2D6CYP2C9 | |
| SCHEMBL27580829 | 0.69 | CYP1A2 (0.51) | HTR2CCYP1A2CYP3A4HTR1ACYP2D6 | |
| Hydrochloric Acid SCHEMBL6293547 | 0.68 | CYP1A2 (0.50) | HTR2CCYP1A2CYP3A4HTR1ACYP2D6 | |
| SCHEMBL30740802 | 0.67 | S1PR1 (0.41) | — | |
| SCHEMBL30740819 | 0.67 | SIGMAR1 (0.36) | — | |
| SCHEMBL29103497 | 0.67 | S1PR1 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117043154-A | GPCR receptor agonists, pharmaceutical compositions comprising same, and methods of use thereof | 卡莫特医疗有限公司 | 2023-11-10 | — | — | CN | disclosed |