Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | KCNK3 | O14649 | 3/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6561835 | 0.92 | PTPN11 (0.35) | PTPN11HRH3HSD11B1GAAALDH1A1 | |
| SCHEMBL6563002 | 0.91 | HRH3 (0.42) | PTPN11HRH3HSD11B1GAAALDH1A1 | |
| SCHEMBL6563752 | 0.90 | GAA (0.35) | HRH3HSD11B1GAAALDH1A1HPGD | |
| SCHEMBL6565533 | 0.88 | ACACB (0.45) | PTPN11HSD11B1GAAALDH1A1DDB1 | |
| SCHEMBL6563779 | 0.87 | KCNK3 (0.38) | PTPN11HSD11B1GAAKCNK3 | |
| SCHEMBL6563605 | 0.87 | GAA (0.37) | HRH3HSD11B1GAAALDH1A1HPGD | |
| SCHEMBL6561843 | 0.87 | GAA (0.31) | PTPN11HRH3HSD11B1GAANAMPT | |
| SCHEMBL6563725 | 0.86 | GAA (0.33) | PTPN11GAAALDH1A1NPC1DDB1 | |
| SCHEMBL7676439 | 0.85 | HSD11B1 (0.32) | PTPN11HSD11B1GAANPC1DDB1 | |
| SCHEMBL6565215 | 0.85 | PIK3CA (0.38) | PTPN11DDB1CRBNACACB |
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-1140802-B1 | SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES, THEIR PRODUCTION AND THEIR USE AS MEDICINES | BOEHRINGER INGELHEIM PHARMA (DE) | 2004-03-17 | — | — | EP | disclosed |
| US-6479524-B1 | TO PROLONG THE THROMBIN TIME | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2002-11-12 | — | — | US | disclosed |