Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | GHSR | Q92847 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MLNR | O43193 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9874777 | 1.00 | FDPS (0.40) | FDPSCYP2D6CYP1A2MEN1LMNA | |
| SCHEMBL18360656 | 0.95 | FDPS (0.34) | FDPSGHSRSSTR2 | |
| SCHEMBL25562847 | 0.95 | FDPS (0.34) | FDPSGHSRSSTR2 | |
| SCHEMBL17484303 | 0.85 | FDPS (0.42) | FDPSCYP2D6CYP1A2MEN1LMNA | |
| SCHEMBL28871650 | 0.84 | FDPS (0.39) | FDPSCYP2D6CYP1A2MEN1LMNA | |
| SCHEMBL26618343 | 0.82 | CYP2D6 (0.41) | FDPSCYP2D6CYP1A2MEN1LMNA | |
| SCHEMBL26618361 | 0.82 | CYP2D6 (0.41) | FDPSCYP2D6CYP1A2MEN1LMNA | |
| SCHEMBL9874771 | 0.82 | CYP2D6 (0.37) | FDPSCYP2D6CYP1A2MEN1LMNA | |
| SCHEMBL4144285 | 0.81 | SLC6A2 (0.36) | FDPSCYP2D6CYP1A2MEN1LMNA | |
| SCHEMBL4158323 | 0.79 | CYP2D6 (0.40) | FDPSCYP2D6CYP1A2MEN1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022064187-A1 | COMPOUNDS AS MODULATORS OF ENDOPLASMIC RETICULUM AMINOPEPTIDASE 1 (ERAP1) | Grey Wolf Therapeutics Limited (GB) | 2022-03-31 | — | — | WO | disclosed |
| WO-1991017981-A1 | AZACYCLIC DERIVATIVES | DR. LO. ZAMBELETTI S.P.A. (IT) | 1991-11-28 | — | — | WO | disclosed |