Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | NAMPT | P43490 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.33 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 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 | |
|---|---|---|---|---|
| SCHEMBL6563752 | 0.91 | GAA (0.35) | GAAALDH1A1HPGDNAMPTHTT | |
| SCHEMBL6563591 | 0.91 | LRRK2 (0.39) | GAAALDH1A1HPGDNAMPTHTT | |
| SCHEMBL6563002 | 0.88 | HRH3 (0.42) | GAAALDH1A1HPGDNAMPTHRH3 | |
| SCHEMBL6565417 | 0.87 | PTPN11 (0.36) | GAAALDH1A1HPGDNAMPTHRH3 | |
| SCHEMBL6563568 | 0.87 | CNR2 (0.39) | GAAHPGDNAMPTHTTMEN1 | |
| SCHEMBL6563507 | 0.85 | KCNK3 (0.31) | GAAALDH1A1HPGDNAMPTHTT | |
| SCHEMBL6565356 | 0.84 | GAA (0.42) | GAAALDH1A1HPGDNAMPTHTT | |
| SCHEMBL6565221 | 0.83 | SMN1; SMN2 (0.41) | GAAALDH1A1HPGDNAMPTMAPK1 | |
| SCHEMBL6561835 | 0.82 | PTPN11 (0.35) | GAAALDH1A1HPGDNAMPTHTT | |
| SCHEMBL6561938 | 0.79 | ABL1 (0.36) | GAAALDH1A1HPGDMEN1KMT2A |
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 |