Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | IMPDH2 | P12268 | 4/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HTR1F | P30939 | 1/20 | 0.32 |
| ▸ | BRAF | P15056 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | NT5E | P21589 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8549783 | 0.85 | GRM5 (0.37) | GRM5IMPDH2ROCK2NAMPTKDR | |
| SCHEMBL8191280 | 0.84 | HTR1F (0.50) | GRM5MAPTHTR1FALDH1A1LMNA | |
| SCHEMBL5906312 | 0.75 | HTR1F (0.51) | GRM5HTR1FKDM4ENPC1ALDH1A1 | |
| SCHEMBL8551891 | 0.69 | HTR1F (0.49) | ROCK2NAMPTKDRTP53MAPT | |
| Cadaverine Tartrate SCHEMBL8551708 | 0.68 | MAP1LC3B (0.36) | MAPTBRAFKDM4E | |
| Benzoic Acid SCHEMBL8704380 | 0.66 | TRPV1 (0.44) | ROCK2TP53MAPTBRAFNPC1 | |
| Malonic Acid SCHEMBL8548925 | 0.66 | HTR1F (0.47) | NAMPTKDRTP53MAPTHTR1F | |
| SCHEMBL8550328 | 0.65 | FLT1 (0.37) | KDRTP53MAPTHTR1FNPC1 | |
| Benzoic Acid SCHEMBL8548987 | 0.65 | NPC1 (0.35) | TP53MAPTNPC1ALDH1A1LMNA | |
| SCHEMBL5785469 | 0.64 | TRPV1 (0.64) | GRM5TP53MAPTKDM4ENPC1 |
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-0835869-A2 | New serotonin 5-HT1F agonists | ELI LILLY AND COMPANY (US) | 1998-04-15 | — | — | EP | disclosed |