Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.48 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | XIAP | P98170 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | AIMP2 | Q13155 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20182997 | 0.80 | GRM7 (0.57) | P2RX7GRM7XIAPHCRTR2 | |
| SCHEMBL21542223 | 0.80 | GRM7 (0.57) | P2RX7GRM7XIAPHCRTR2 | |
| SCHEMBL21542222 | 0.80 | GRM7 (0.57) | P2RX7GRM7XIAPHCRTR2 | |
| SCHEMBL20182824 | 0.75 | LTB4R (0.56) | GRM7PSMB5POLBAIMP2CYP1A2 | |
| SCHEMBL20182869 | 0.74 | AIMP2 (0.56) | GRM7PSMB5POLBAIMP2CYP1A2 | |
| SCHEMBL20182939 | 0.74 | PSMB5 (0.50) | P2RX7PSMB5POLBAIMP2CYP1A2 | |
| SCHEMBL20182774 | 0.73 | PSMB5 (0.52) | P2RX7PSMB5POLBAIMP2CYP1A2 | |
| SCHEMBL25626161 | 0.73 | PSMB5 (0.49) | P2RX7LMNAPSMB5POLBAIMP2 | |
| SCHEMBL20182785 | 0.73 | AIMP2 (0.52) | P2RX7GRM7PSMB5POLBAIMP2 | |
| SCHEMBL21542206 | 0.72 | GRM7 (0.61) | P2RX7GRM7POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-3541812-B1 | MGLUR7 AGONIST COMPOUNDS FOR TREATING MGLUR7- REGULATED DISEASES, DISORDERS, OR CONDITIONS | TAKEDA PHARMACEUTICALS CO (JP) | 2023-06-14 | — | — | EP | disclosed |