Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.51 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | CASP7 | P55210 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 6/20 | 0.42 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 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 | |
|---|---|---|---|---|
| SCHEMBL9697639 | 0.89 | NR1H2 (0.55) | NR1H2NR1H3GAAKDM4EALDH1A1 | |
| SCHEMBL9696908 | 0.81 | ALOX5 (0.56) | GAAKDM4EALDH1A1LMNAHPGD | |
| SCHEMBL9697037 | 0.77 | GAA (0.65) | NR1H2NR1H3GAAKDM4EALDH1A1 | |
| SCHEMBL9698079 | 0.76 | ALOX5 (0.53) | NR1H2NR1H3GAAKDM4EALDH1A1 | |
| SCHEMBL9698103 | 0.75 | ALOX5 (0.52) | NR1H2NR1H3GAAKDM4EALDH1A1 | |
| SCHEMBL9696910 | 0.75 | ADORA2B (0.49) | NR1H2NR1H3GAAKDM4EALDH1A1 | |
| SCHEMBL9696986 | 0.73 | ALOX5 (0.64) | NR1H2NR1H3GAAKDM4EALDH1A1 | |
| SCHEMBL9695875 | 0.72 | GAA (0.47) | NR1H2NR1H3GAAKDM4EALDH1A1 | |
| SCHEMBL9697631 | 0.72 | KDM4E (0.50) | NR1H2NR1H3GAAKDM4EALDH1A1 | |
| SCHEMBL9695865 | 0.70 | KDM4E (0.45) | GAAKDM4EALDH1A1SMN1; SMN2LMNA |
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-1992003419-A1 | ISOCARBOSTIRYL COMPOUNDS AND ANTITUMOR USE THEREOF | SYNPHAR LABORATORIES, INC. (CA) | 1992-03-05 | — | — | WO | claimed |