Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | NAAA | Q02083 | 1/20 | 0.46 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | MMP2 | P08253 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | PDE4A | P27815 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | ACACB | O00763 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | MMP3 | P08254 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10566464 | 0.89 | RAB9A (0.56) | RAB9AALDH1A1MAPTL3MBTL1LMNA | |
| SCHEMBL10569744 | 0.85 | ALDH1A1 (0.51) | RAB9AALDH1A1MAPTL3MBTL1MAPK1 | |
| SCHEMBL11002749 | 0.83 | LMNA (0.58) | ALDH1A1L3MBTL1LMNAMAPK1KDM4E | |
| SCHEMBL3801206 | 0.80 | TBXAS1 (0.60) | ALDH1A1MAPTL3MBTL1LMNAKDM4E | |
| SCHEMBL2669742 | 0.80 | L3MBTL1 (0.66) | RAB9AALDH1A1MAPTL3MBTL1LMNA | |
| SCHEMBL4801215 | 0.78 | CYP2A6 (0.50) | RAB9AALDH1A1MAPTLMNAMAPK1 | |
| SCHEMBL11564142 | 0.78 | PARP15 (0.49) | RAB9AALDH1A1MAPTLMNAMAPK1 | |
| SCHEMBL3276405 | 0.78 | ALDH1A1 (0.58) | ALDH1A1MAPTL3MBTL1MMP2KDM4E | |
| SCHEMBL13348627 | 0.77 | KDM4E (0.66) | ALDH1A1LMNAKDM4ECYP1A2CYP2D6 | |
| SCHEMBL2628190 | 0.75 | SMN1; SMN2 (0.59) | RAB9AALDH1A1L3MBTL1LMNAMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4834905-A | LIQUID CRYSTAL DIELECTRICS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1989-05-30 | — | — | US | disclosed |
| US-4627933-A | ESTERS, ETHERS, NITRICES, HALIDES, OR HYDROCARBONS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1986-12-09 | — | — | US | disclosed |