Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 2/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | MAPT | P10636 | 6/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ESPL1 | Q14674 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 2/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9030857 | 1.00 | AR (0.43) | ARAKR1B1ALDH1A1MAPTLMNA | |
| SCHEMBL19030581 | 0.81 | MAPT (0.51) | AKR1B1ALDH1A1MAPTLMNAHTT | |
| SCHEMBL27964810 | 0.81 | AKR1B1 (0.36) | AKR1B1ALDH1A1MAPTLMNAHTT | |
| SCHEMBL20798131 | 0.80 | AR (0.48) | AR | |
| SCHEMBL20804904 | 0.76 | AR (0.45) | AR | |
| SCHEMBL9030621 | 0.75 | PGR (0.35) | ARAKR1B1ALDH1A1MAPTLMNA | |
| SCHEMBL9030626 | 0.75 | PGR (0.35) | ARAKR1B1ALDH1A1MAPTLMNA | |
| SCHEMBL16893979 | 0.75 | AR (0.44) | ARAKR1B1 | |
| SCHEMBL8564041 | 0.74 | ALDH1A1 (0.50) | ARAKR1B1ALDH1A1MAPTLMNA | |
| SCHEMBL5517411 | 0.74 | ALDH1A1 (0.51) | ARALDH1A1HTTGAAPGR |
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-0732334-A1 | Piperidine derivatives, process for their preparation and their therapeutic application | SYNTHELABO (FR) | 1996-09-18 | — | — | EP | disclosed |