Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 4/20 | 0.52 |
| ▸ | HTT | P42858 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | HTR1E | P28566 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.48 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7309058 | 0.96 | AKR1C3 (0.56) | AKR1C3HTTLMNAMEN1HTR1E | |
| SCHEMBL7303382 | 0.87 | KDM4E (0.54) | AKR1C3HTTLMNAMEN1HTR1E | |
| SCHEMBL7310135 | 0.85 | LMNA (0.62) | AKR1C3HTTLMNAMEN1HTR1E | |
| SCHEMBL830749 | 0.85 | RAB9A (0.64) | MEN1KMT2AKDM4EHPGDTP53 | |
| SCHEMBL7301886 | 0.84 | KDM4E (0.57) | AKR1C3HTTLMNAMEN1HTR1E | |
| SCHEMBL2677586 | 0.83 | CNR2 (0.63) | HTTLMNAMEN1HTR1EKMT2A | |
| SCHEMBL6852416 | 0.83 | KDM4E (0.62) | HTTMEN1KMT2AKDM4EHPGD | |
| SCHEMBL7298745 | 0.82 | HPGD (0.69) | HTTLMNAKMT2AKDM4EHPGD | |
| SCHEMBL2677776 | 0.82 | CNR2 (0.62) | HTTLMNAMEN1HTR1EKMT2A | |
| SCHEMBL1574686 | 0.79 | CYP3A4 (0.53) | MEN1KMT2AKDM4ETP53RAB9A |
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-0520336-A2 | Aldehyde derivatives and their use as calpain inhibitors | FUJIREBIO Inc. (JP) | 1992-12-30 | — | — | EP | disclosed |