Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.53 |
| ▸ | IDO1 | P14902 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.47 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.47 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.47 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.46 |
| ▸ | BRD2 | P25440 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1011568 | 0.79 | IDO1 (0.54) | IDO1ALDH1A1MAPTRAD51KDM4E | |
| SCHEMBL19563752 | 0.79 | IDO1 (0.60) | IDO1ALDH1A1MAPTRAD51KDM4E | |
| SCHEMBL8809532 | 0.75 | PKM (0.48) | IDO1ALDH1A1MAPTRAD51KDM4E | |
| SCHEMBL897183 | 0.75 | RAB9A (0.61) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL10526068 | 0.74 | ALDH1A1 (0.56) | ALDH1A1MAPTRAD51KDM4EMEN1 | |
| Hydrochloric Acid SCHEMBL8808042 | 0.74 | PKM (0.47) | IDO1ALDH1A1MAPTRAD51KDM4E | |
| SCHEMBL2322209 | 0.74 | ALDH1A1 (0.67) | IDO1ALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL1895964 | 0.73 | ALDH1A1 (0.53) | IDO1ALDH1A1MAPTRAD51KDM4E | |
| Hydrochloric Acid SCHEMBL1375757 | 0.73 | BRD4 (0.45) | BRD4ALDH1A1MAPTRIPK1BRD2 | |
| SCHEMBL17736670 | 0.72 | IDO1 (0.59) | IDO1ALDH1A1MAPTRAD51KDM4E |
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-2014111871-A1 | 4,5-DIHYDROISOXAZOLE DERIVATIVES AS NAMPT INHIBITORS | AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) | 2014-07-24 | — | — | WO | disclosed |