Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PHGDH | O43175 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.35 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.35 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.34 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29931890 | 1.00 | DRD4 (0.42) | DRD4GRM2POLBPHGDHADORA2A | |
| SCHEMBL23536434 | 0.81 | DRD4 (0.47) | DRD4GRM2POLBPHGDHADORA2A | |
| SCHEMBL29931887 | 0.81 | DRD4 (0.47) | DRD4GRM2POLBPHGDHADORA2A | |
| SCHEMBL23536198 | 0.79 | GRM2 (0.40) | DRD4GRM2POLBPHGDHADORA2A | |
| SCHEMBL23536212 | 0.75 | HRH4 (0.47) | POLBHRH4ALDH1A1LMNA | |
| SCHEMBL29931770 | 0.73 | DRD4 (0.47) | DRD4GRM2POLBPHGDHADORA2A | |
| SCHEMBL23536253 | 0.73 | DRD4 (0.47) | DRD4GRM2POLBPHGDHADORA2A | |
| SCHEMBL29931979 | 0.72 | SSTR2 (0.45) | DRD4GRM2POLBPHGDHHTR3A | |
| SCHEMBL23536333 | 0.72 | SSTR2 (0.45) | DRD4GRM2POLBPHGDHHTR3A | |
| SCHEMBL30232382 | 0.72 | GRM2 (0.42) | DRD4GRM2POLBPHGDHDRD2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115087440-A | TRPML modulators | 卡斯玛治疗公司 | 2022-09-20 | — | — | CN | disclosed |
| WO-2021127337-A1 | TRPML MODULATORS | CASMA THERAPEUTICS, INC. (US) | 2021-06-24 | — | — | WO | disclosed |