Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.39 |
| ▸ | PRNP | P04156 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.39 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.37 |
| ▸ | BCKDK | O14874 | 2/20 | 0.37 |
| ▸ | RPA1 | P27694 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14615049 | 0.88 | CYP2C9 (0.44) | ALDH1A1MAPTKDM4EGAARXFP1 | |
| SCHEMBL14615113 | 0.82 | ALDH1A1 (0.49) | ALDH1A1MAPTKDM4EGAAMEN1 | |
| SCHEMBL30671951 | 0.77 | MCL1 (0.53) | ALDH1A1MAPTKDM4EGAARXFP1 | |
| SCHEMBL6840191 | 0.77 | MCL1 (0.53) | ALDH1A1MAPTKDM4EGAARXFP1 | |
| SCHEMBL14615109 | 0.77 | CYP2A6 (0.36) | ALDH1A1MAPTKDM4EGAARXFP1 | |
| SCHEMBL11625359 | 0.77 | RXFP1 (0.47) | ALDH1A1MAPTKDM4EGAARXFP1 | |
| SCHEMBL13694599 | 0.75 | L3MBTL1 (0.47) | ALDH1A1MAPTKDM4EGAARXFP1 | |
| SCHEMBL11626086 | 0.74 | ALDH1A1 (0.47) | ALDH1A1MAPTKDM4EGAARXFP1 | |
| SCHEMBL25202699 | 0.74 | MCL1 (0.65) | ALDH1A1MAPTKDM4ERXFP1MEN1 | |
| SCHEMBL11624275 | 0.71 | LMNA (0.52) | ALDH1A1MAPTKDM4EGAAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007016784-A1 | NOVEL SUBSTITUTED 1,2,3-TΠAZOLYLMETHYL-BENZOTHIOPHENE OR -INDOLE AND THEIR USE AS LEUKOTΠENE BIOSYNTHESIS INHIBITORS | MERCK FROSST CANADA LTD. (CA) | 2007-02-15 | — | — | WO | disclosed |