Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 4/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | MMP3 | P08254 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CHKA | P35790 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8860937 | 0.81 | HPGD (0.52) | HPGDALDH1A1HTTHSD11B1TSHR | |
| SCHEMBL3060452 | 0.79 | HPGD (0.48) | HPGDALDH1A1HTTHSD11B1TSHR | |
| SCHEMBL2200249 | 0.73 | HPGD (0.47) | HPGDALDH1A1HTTHSD11B1TSHR | |
| SCHEMBL6132882 | 0.69 | ALDH1A1 (0.42) | HPGDALDH1A1HTTHSD11B1TSHR | |
| SCHEMBL4372871 | 0.68 | HPGD (0.56) | HPGDALDH1A1HTTHSD11B1TSHR | |
| SCHEMBL9717393 | 0.67 | ALDH1A1 (0.61) | HPGDALDH1A1HTTPOLBMMP1 | |
| SCHEMBL4840666 | 0.67 | ALDH1A1 (0.61) | HPGDALDH1A1HTTPOLBMMP1 | |
| SCHEMBL8024247 | 0.67 | ALDH1A1 (0.61) | HPGDALDH1A1HTTPOLBMMP1 | |
| SCHEMBL4261207 | 0.67 | ALDH1A1 (0.61) | HPGDALDH1A1HTTPOLBMMP1 | |
| SCHEMBL5231305 | 0.66 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0927192-A1 | MODIFIED AMINOACIDS, PHARMACEUTICALS CONTAINING THESE COMPOUNDS AND METHOD FOR THEIR PRODUCTION | Dr. Karl Thomae GmbH (DE) | 1999-07-07 | — | — | EP | disclosed |
| WO-1998011128-A1 | MODIFIED AMINOACIDS, PHARMACEUTICALS CONTAINING THESE COMPOUNDS AND METHOD FOR THEIR PRODUCTION | DR. KARL THOMAE GMBH (DE) | 1998-03-19 | — | — | WO | disclosed |