Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | BID | P55957 | 3/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.35 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.35 |
| ▸ | BAK1 | Q16611 | 2/20 | 0.35 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.35 |
| ▸ | SAE1 | Q9UBE0 | 2/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | EP300 | Q09472 | 1/20 | 0.35 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.35 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8761536 | 0.85 | ALDH1A1 (0.44) | ALDH1A1TSHRTDP1CA2ATM | |
| SCHEMBL4596045 | 0.79 | CYP2C9 (0.47) | ALDH1A1TSHRTDP1CA2ATM | |
| Hexane SCHEMBL27260332 | 0.72 | ALDH1A1 (0.75) | ALDH1A1TSHRTDP1CA2ATM | |
| Heptane SCHEMBL27259929 | 0.71 | ALDH1A1 (0.72) | ALDH1A1TSHRTDP1CA2ATM | |
| SCHEMBL21137911 | 0.71 | MEN1 (0.44) | ALDH1A1ATMMAPTMEN1HTT | |
| SCHEMBL16054167 | 0.70 | MEN1 (0.43) | ALDH1A1ATMMAPTMEN1HTT | |
| SCHEMBL7198536 | 0.70 | ALDH1A1 (0.53) | ALDH1A1TSHRTDP1CA2ATM | |
| SCHEMBL28958219 | 0.69 | ALDH1A1 (0.56) | ALDH1A1TSHRTDP1CA2ATM | |
| Pentane SCHEMBL27743488 | 0.69 | ALDH1A1 (0.75) | ALDH1A1TSHRTDP1CA2ATM | |
| SCHEMBL4594554 | 0.69 | ALDH1A1 (0.56) | ALDH1A1TSHRTDP1CA2ATM |
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-1304328-A1 | PROCESS FOR THE PREPARATION OF A BENZOFURAN DERIVATIVE | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2003-04-23 | — | — | EP | disclosed |