Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | NPY1R | P25929 | 2/20 | 0.31 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.31 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.30 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9201321 | 0.78 | SMN1; SMN2 (0.34) | SMN1; SMN2ALDH1A1MAPTHTTNPSR1 | |
| SCHEMBL7040008 | 0.77 | NPY1R (0.36) | CYP2D6CYP3A4NPY1RNPY5R | |
| SCHEMBL8526196 | 0.75 | NPY1R (0.40) | ALDH1A1NPY1RNPY5R | |
| SCHEMBL8526214 | 0.75 | HTR2A (0.35) | ALDH1A1MAPTKDM4EATMTACR1 | |
| SCHEMBL8125374 | 0.74 | NPY1R (0.33) | MAPTHTTNPSR1NPY1R | |
| SCHEMBL8126341 | 0.73 | F2 (0.38) | ALDH1A1MAPTHTTNPSR1NPY1R | |
| SCHEMBL8122094 | 0.72 | F2 (0.37) | ALDH1A1MAPTHTTNPSR1NPY1R | |
| SCHEMBL8119504 | 0.72 | CNR1 (0.40) | ALDH1A1NPY1R | |
| SCHEMBL9201153 | 0.72 | CNR1 (0.34) | MAPTKDM4EATMHTTNPSR1 | |
| SCHEMBL8126826 | 0.72 | CNR1 (0.37) | ALDH1A1MAPTHTTNPSR1NPY1R |
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-0680469-B1 | AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME | BOEHRINGER INGELHEIM PHARMA (DE) | 2000-04-26 | — | — | EP | disclosed |