Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.39 |
| ▸ | NPY1R | P25929 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | MC4R | P32245 | 1/20 | 0.36 |
| ▸ | MC3R | P41968 | 1/20 | 0.36 |
| ▸ | MC1R | Q01726 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8119335 | 0.94 | TRPV1 (0.41) | GAACYP3A4TSHRKMT2AMEN1 | |
| SCHEMBL8120923 | 0.88 | NPY1R (0.39) | NPY1RMC4RMC3RMC1R | |
| SCHEMBL8122078 | 0.88 | CASR (0.44) | RAB9ANPY1RALDH1A1 | |
| SCHEMBL8129753 | 0.87 | BCHE (0.40) | KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL8112524 | 0.86 | KMT2A (0.47) | GAATSHRRAB9AKMT2AMEN1 | |
| SCHEMBL4651537 | 0.85 | CYP3A4 (0.46) | GAACYP3A4TSHRKDM4EALOX15 | |
| SCHEMBL8122083 | 0.85 | NPY1R (0.40) | NPY1RMC4RMC3RMC1R | |
| SCHEMBL8119334 | 0.83 | NPY1R (0.47) | NPY1R | |
| SCHEMBL8128352 | 0.82 | PADI4 (0.39) | NPY1RMC4RMC3RMC1R | |
| SCHEMBL8120019 | 0.82 | ITGB3 (0.41) | GAAKDM4EKMT2AMEN1ALDH1A1 |
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 |