Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | REN | P00797 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18686112 | 0.91 | ALDH1A1 (0.35) | ALDH1A1KDM4EMEN1KMT2ACHRM2 | |
| SCHEMBL24938407 | 0.88 | KDM4E (0.34) | ALDH1A1KDM4EMEN1KMT2ACHRM2 | |
| SCHEMBL21169166 | 0.80 | EPHX1 (0.40) | ALDH1A1KDM4EHDAC3HDAC1HDAC2 | |
| SCHEMBL18686103 | 0.79 | EPHX1 (0.49) | ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL21162720 | 0.76 | EPHX1 (0.39) | ALDH1A1KDM4E | |
| SCHEMBL18686104 | 0.74 | ALDH1A1 (0.50) | ALDH1A1KDM4EMEN1KMT2AHDAC3 | |
| SCHEMBL18686291 | 0.73 | ALDH1A1 (0.49) | ALDH1A1KDM4EMEN1KMT2AHDAC3 | |
| SCHEMBL24938373 | 0.67 | EPHX1 (0.38) | MEN1KMT2A | |
| SCHEMBL18686272 | 0.67 | EPHX1 (0.37) | MEN1KMT2A | |
| SCHEMBL2866869 | 0.62 | EPHX1 (0.65) | ALDH1A1HDAC3HDAC1HDAC2SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4119539-A1 | PRODRUGS OF GAMMA-HYDROXYBUTYRIC ACID, COMPOSITIONS AND USES THEREOF | XWPharma Ltd. (KY) | 2023-01-18 | — | — | EP | disclosed |
| WO-2017050259-A1 | PRODRUGS OF GAMMA-HYDROXYBUTYRIC ACID, COMPOSITIONS AND USES THEREOF | XW LABORATORIES INC. (KY) | 2017-03-30 | — | — | WO | disclosed |