Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | POLB | P06746 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | AHR | P35869 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Isomyristicin SCHEMBL30678763 | 0.82 | ALDH1A1 (0.52) | ALDH1A1POLBKDM4ETDP1L3MBTL1 | |
| SCHEMBL7199637 | 0.81 | ALDH1A1 (0.52) | ALDH1A1POLBKDM4ETDP1L3MBTL1 | |
| SCHEMBL30365889 | 0.81 | ALDH1A1 (0.52) | ALDH1A1POLBKDM4ETDP1L3MBTL1 | |
| SCHEMBL7199640 | 0.81 | ALDH1A1 (0.52) | ALDH1A1POLBKDM4ETDP1L3MBTL1 | |
| SCHEMBL31242688 | 0.80 | LMNA (0.54) | ALDH1A1POLBKDM4ETDP1L3MBTL1 | |
| SCHEMBL1418594 | 0.80 | LMNA (0.54) | ALDH1A1POLBKDM4ETDP1L3MBTL1 | |
| SCHEMBL5334967 | 0.80 | ALDH1A1 (0.51) | ALDH1A1POLBKDM4ETDP1L3MBTL1 | |
| SCHEMBL5334970 | 0.80 | ALDH1A1 (0.51) | ALDH1A1POLBKDM4ETDP1L3MBTL1 | |
| SCHEMBL30887914 | 0.80 | POLB (0.65) | ALDH1A1POLBKDM4ETDP1L3MBTL1 | |
| SCHEMBL30887918 | 0.80 | POLB (0.65) | ALDH1A1POLBKDM4ETDP1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7332622-B2 | Process for preparing optically active nitro compounds and cyano compounds | KANTO KAGUKU KABUSHIKI KAISHA (JP) | 2008-02-19 | — | — | US | disclosed |