Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.65 |
| ▸ | MEN1 | O00255 | 4/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.65 |
| ▸ | MAPT | P10636 | 4/20 | 0.65 |
| ▸ | HTT | P42858 | 3/20 | 0.65 |
| ▸ | LMNA | P02545 | 2/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.65 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.60 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.59 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL6691518 | 0.92 | PTGS1 (0.58) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL6686099 | 0.92 | MAPT (0.55) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL6679221 | 0.90 | ALDH1A1 (0.74) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL18742319 | 0.90 | ALDH1A1 (0.74) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL6684359 | 0.89 | ALDH1A1 (0.52) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL6688392 | 0.89 | KMT2A (0.65) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL23392538 | 0.89 | HDAC1 (0.72) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL6680296 | 0.89 | HDAC1 (0.72) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL23392542 | 0.87 | HDAC1 (0.61) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL6687187 | 0.86 | ALDH1A1 (0.67) | ALDH1A1MEN1KMT2AKDM4EMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004043951-A1 | PYRAZOLE DERIVATIVES AS MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS | CAREX S.A. (FR) | 2004-05-27 | — | — | WO | claimed |
| WO-2004043951-A1 | PYRAZOLE DERIVATIVES AS MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS | CAREX S.A. (FR) | 2004-05-27 | — | — | WO | disclosed |