Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.36 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | MC4R | P32245 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.32 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.32 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.32 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22415187 | 0.89 | USP2 (0.36) | SIGMAR1PAOXUSP2MC4RCHRM2 | |
| SCHEMBL22415165 | 0.84 | PAOX (0.34) | SIGMAR1PAOXUSP2MC4RCHRM2 | |
| SCHEMBL25668355 | 0.83 | CARM1 (0.41) | CYP1A2KDM4E | |
| SCHEMBL22415210 | 0.82 | SIGMAR1 (0.43) | SIGMAR1USP2KDM4E | |
| SCHEMBL18911024 | 0.79 | SIGMAR1 (0.35) | SIGMAR1PAOXUSP2MC4RGAA | |
| SCHEMBL13775157 | 0.78 | GAA (0.41) | SIGMAR1PAOXMC4RCHRM2CHRM1 | |
| SCHEMBL18893467 | 0.77 | ALDH1A1 (0.44) | SIGMAR1USP2CHRM2CHRM1CYP1A2 | |
| SCHEMBL15187075 | 0.77 | LMNA (0.38) | SIGMAR1PAOXUSP2CHRM2CHRM4 | |
| SCHEMBL20850663 | 0.77 | USP2 (0.41) | SIGMAR1PAOXUSP2CHRM2CHRM4 | |
| SCHEMBL18501646 | 0.77 | GNAI3 (0.44) | SIGMAR1PAOXUSP2GAALMNA |
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-3265452-B1 | PEPTIDYL NITRIL COMPOUNDS AS DIPEPTIDYL PEPTIDASE I INHIBITORS | Neuprozyme Therapeutics ApS (DK) | 2020-03-04 | — | — | EP | disclosed |