Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 10/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL26807679 | 0.88 | DRD2 (0.45) | MCHR1KCNH2DRD4SIGMAR1DRD3 | |
| SCHEMBL26817271 | 0.82 | HRH3 (0.40) | HRH3ACHESIGMAR1 | |
| SCHEMBL26817286 | 0.79 | HTR1A (0.37) | HRH3SIGMAR1 | |
| SCHEMBL26817285 | 0.79 | GRM2 (0.38) | MCHR1KCNH2HRH3HTR6GRM2 | |
| SCHEMBL26817278 | 0.78 | HTR1A (0.36) | KCNH2SIGMAR1 | |
| SCHEMBL22017134 | 0.75 | ATM (0.38) | ALDH1A1 | |
| SCHEMBL26815145 | 0.72 | AR (0.39) | ALDH1A1 | |
| SCHEMBL22016170 | 0.71 | KIF11 (0.42) | ALDH1A1 | |
| SCHEMBL22017359 | 0.67 | KDM4E (0.36) | ALDH1A1 | |
| SCHEMBL26817066 | 0.65 | ALDH1A1 (0.46) | ALDH1A1 |
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-2023220741-A1 | ALPHA 4 BETA 7 INTEGRIN MODULATORS AND USES THEREOF | DICE MOLECULES SV, INC. (US) | 2023-11-16 | — | — | WO | disclosed |