Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.41 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8439355 | 0.93 | GSK3A (0.44) | CYP1A2CYP3A4CYP2D6MEN1KMT2A | |
| SCHEMBL8772454 | 0.89 | POLB (0.42) | MEN1KMT2AALDH1A1GAAFKBP1A | |
| SCHEMBL8772533 | 0.87 | KCNA5 (0.42) | CYP3A4MEN1KMT2AALDH1A1GAA | |
| SCHEMBL8623161 | 0.86 | GSK3B (0.39) | MEN1KMT2AALDH1A1GSK3AGSK3B | |
| SCHEMBL8442958 | 0.83 | MAPT (0.47) | MEN1KMT2AFKBP1APOLBLMNA | |
| SCHEMBL8552263 | 0.80 | HRH1 (0.39) | CYP1A2CYP2D6KMT2AALDH1A1CYP2C19 | |
| SCHEMBL8104154 | 0.78 | FAAH (0.44) | CYP1A2CYP3A4CYP2D6HTR2AMEN1 | |
| SCHEMBL8442243 | 0.75 | TRPV1 (0.49) | KMT2AALDH1A1GAAHPGDFKBP1A | |
| SCHEMBL8772402 | 0.74 | HTR2A (0.43) | CYP1A2CYP3A4CYP2D6HTR2AKDM4E | |
| SCHEMBL8772491 | 0.74 | HTR2A (0.42) | HTR2AMEN1KMT2AALDH1A1GAA |
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-0799200-A1 | SUBSTITUTED AZETIDIN-2-ONES FOR TREATMENT OF ATHEROSCLEROSIS | SMITHKLINE BEECHAM PLC (GB) | 1997-10-08 | — | — | EP | disclosed |