Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTCH1 | P46531 | 11/20 | 0.47 |
| ▸ | NOTCH3 | Q9UM47 | 8/20 | 0.47 |
| ▸ | RBPJ | Q06330 | 3/20 | 0.41 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | SI | P14410 | 1/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.33 |
| ▸ | RELA | Q04206 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15608508 | 0.87 | NOTCH1 (0.54) | NOTCH1NOTCH3RBPJMGAMGAA | |
| SCHEMBL15608509 | 0.87 | NOTCH1 (0.54) | NOTCH1NOTCH3RBPJMGAMGAA | |
| SCHEMBL23769413 | 0.78 | NOTCH1 (0.52) | NOTCH1NOTCH3RBPJMGAMGAA | |
| SCHEMBL15608401 | 0.76 | NOTCH1 (0.53) | NOTCH1NOTCH3RBPJMGAMGAA | |
| SCHEMBL17030708 | 0.74 | NOTCH1 (0.42) | NOTCH1NOTCH3RBPJMAPTALOX15 | |
| SCHEMBL15622551 | 0.74 | NOTCH1 (0.54) | NOTCH1NOTCH3RBPJMEN1KMT2A | |
| SCHEMBL15629462 | 0.74 | NOTCH1 (0.54) | NOTCH1NOTCH3RBPJMEN1KMT2A | |
| SCHEMBL15631538 | 0.74 | NOTCH1 (0.58) | NOTCH1NOTCH3RBPJ | |
| SCHEMBL15622343 | 0.74 | NOTCH1 (0.45) | NOTCH1NOTCH3RBPJBRD4 | |
| SCHEMBL15622249 | 0.74 | NOTCH1 (0.58) | NOTCH1NOTCH3RBPJ |
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-2021163676-A1 | METHODS OF PREPARING CHIRAL BENZODIAZEPINONE DERIVATIVES | AYALA PHARMACEUTICALS INC. (US) | 2021-08-19 | — | — | WO | disclosed |