Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | PLG | P00747 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.36 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | CFTR | P13569 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7835958 | 0.78 | GAA (0.46) | GAAKDM4EALDH1A1EPHX2NFKB1 | |
| SCHEMBL2842186 | 0.77 | EPHX2 (0.46) | GAAEPHX2NFKB1NFKB2RELA | |
| SCHEMBL26518869 | 0.76 | GAA (0.40) | GAAKDM4EALDH1A1EPHX2NFKB1 | |
| SCHEMBL4806148 | 0.73 | EPHX2 (0.63) | GAAEPHX2NFKB1NFKB2RELA | |
| SCHEMBL651277 | 0.73 | EPHX2 (0.63) | GAAEPHX2NFKB1NFKB2RELA | |
| SCHEMBL651278 | 0.73 | EPHX2 (0.63) | GAAEPHX2NFKB1NFKB2RELA | |
| SCHEMBL29900496 | 0.73 | EPHX2 (0.63) | GAAEPHX2NFKB1NFKB2RELA | |
| SCHEMBL2840913 | 0.72 | GAA (0.41) | GAAALDH1A1HSD17B10EPHX2PLG | |
| SCHEMBL7849572 | 0.72 | ACHE (0.46) | KDM4EPOLBACHE | |
| SCHEMBL7420752 | 0.72 | PYGL (0.47) | GAAEPHX2NFKB1NFKB2RELA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0802922-B1 | NOVEL AMINO ACID DERIVATIVES, METHOD OF PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM PHARMA (DE) | 2001-09-26 | — | — | EP | disclosed |
| EP-0802922-A1 | NOVEL AMINO ACID DERIVATIVES, METHOD OF PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM KG (DE) | 1997-10-29 | — | — | EP | disclosed |
| WO-1995023810-A1 | NOVEL AMINO ACID DERIVATIVES, METHOD OF PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM KG (DE) | 1995-09-08 | — | — | WO | disclosed |