Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 8/20 | 0.41 |
| ▸ | DRD2 | P14416 | 4/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | CDK9 | P50750 | 1/20 | 0.36 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | SRPK1 | Q96SB4 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20525448 | 0.91 | RPS6KB1 (0.41) | HTR6DRD2SCN9APARP1SRPK1 | |
| SCHEMBL20525353 | 0.90 | HDAC1 (0.41) | HTR6DRD2ALDH1A1 | |
| SCHEMBL20525423 | 0.90 | SCN9A (0.42) | HTR6DRD2SCN9ACA12CA1 | |
| SCHEMBL20525428 | 0.86 | KDM4E (0.47) | HTR6DRD2SRPK1ALDH1A1KDM4E | |
| SCHEMBL20525450 | 0.85 | F12 (0.36) | HTR6DRD2FGFR1FGFR4PARP1 | |
| SCHEMBL20525329 | 0.81 | GHSR (0.43) | ALDH1A1 | |
| SCHEMBL20525382 | 0.81 | CYP1A2 (0.38) | HTR6DRD2SCN9APARP1ALDH1A1 | |
| SCHEMBL20525430 | 0.80 | PARP1 (0.41) | HTR6DRD2FGFR1FGFR4PARP1 | |
| SCHEMBL20525346 | 0.80 | SMN1; SMN2 (0.43) | PARP1ALDH1A1KDM4E | |
| SCHEMBL18108947 | 0.80 | HDAC1 (0.48) | SCN9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3080125-B1 | NOVEL AZAINDOLE DERIVATIVES AS SELECTIVE HISTONE DEACETYLASE (HDAC) INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP (KR) | 2018-10-10 | — | — | EP | disclosed |