Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | HPGD | P15428 | 5/20 | 0.48 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.47 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.47 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.41 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6561903 | 0.91 | RAB9A (0.46) | ALDH1A1HPGDRAB9ASMN1; SMN2HTT | |
| SCHEMBL7677322 | 0.88 | ALDH1A1 (0.44) | ALDH1A1HPGDRAB9ASMN1; SMN2HTT | |
| SCHEMBL1615179 | 0.74 | ALDH1A1 (0.65) | ALDH1A1HPGDRAB9ASMN1; SMN2HTT | |
| SCHEMBL1744898 | 0.73 | ALDH1A1 (0.64) | ALDH1A1HPGDRAB9AMAPK13MAPK12 | |
| SCHEMBL10411918 | 0.71 | ALDH1A1 (0.61) | ALDH1A1HPGDRAB9ASMN1; SMN2MAPK13 | |
| SCHEMBL669564 | 0.71 | MAPK13 (0.61) | ALDH1A1HPGDRAB9ASMN1; SMN2HTT | |
| SCHEMBL669563 | 0.71 | MAPK13 (0.61) | ALDH1A1HPGDRAB9ASMN1; SMN2HTT | |
| SCHEMBL16582661 | 0.71 | ALDH1A1 (0.61) | ALDH1A1HPGDRAB9ASMN1; SMN2L3MBTL1 | |
| SCHEMBL2763319 | 0.69 | ACACB (0.47) | NPSR1 | |
| SCHEMBL8037855 | 0.68 | ALDH1A1 (0.50) | ALDH1A1HPGDRAB9ASMN1; SMN2HTT |
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-1140802-B1 | SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES, THEIR PRODUCTION AND THEIR USE AS MEDICINES | BOEHRINGER INGELHEIM PHARMA (DE) | 2004-03-17 | — | — | EP | disclosed |