Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 2/20 | 0.52 |
| ▸ | RGS12 | O14924 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.47 |
| ▸ | GLS | O94925 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PDE6D | O43924 | 2/20 | 0.44 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7042995 | 0.80 | DRD2 (0.59) | DRD2CYP17A1GLSPTGDR2NAMPT | |
| SCHEMBL20828342 | 0.76 | DGAT1 (0.58) | DGAT1RGS12KDM4EALDH1A1KMT2A | |
| SCHEMBL20832631 | 0.74 | MAOA (0.44) | DGAT1 | |
| SCHEMBL18570243 | 0.73 | CYP17A1 (0.61) | ALDH1A1KMT2AMEN1CYP17A1NAMPT | |
| SCHEMBL20828344 | 0.72 | HSD11B1 (0.52) | DGAT1RGS12KDM4EALDH1A1KMT2A | |
| SCHEMBL10249437 | 0.72 | CYP17A1 (0.68) | DRD2CYP17A1GLSPTGDR2NAMPT | |
| SCHEMBL12393054 | 0.72 | BRD4 (0.57) | KDM4EALDH1A1KMT2AMEN1CYP17A1 | |
| SCHEMBL7156537 | 0.71 | MGLL (0.52) | ALDH1A1DRD2GLSGAA | |
| SCHEMBL13234660 | 0.71 | PPARA (0.59) | DRD2TP53LMNA | |
| SCHEMBL9909931 | 0.71 | PTK2 (0.51) | CYP17A1PTGDR2NAMPTBRD4PSMB8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019054430-A1 | AMIDE COMPOUND HAVING AROMATIC HETEROCYCLE | 第一三共株式会社 | 2019-03-21 | — | — | WO | disclosed |