Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 2/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 8/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 8/20 | 0.40 |
| ▸ | RELA | Q04206 | 8/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5308377 | 0.87 | HTR1B (0.57) | HTR1BKCNH2NFKB1NFKB2RELA | |
| SCHEMBL5308304 | 0.86 | HTR1B (0.74) | HTR1BKCNH2NFKB1NFKB2RELA | |
| SCHEMBL14529628 | 0.85 | HTR1B (0.55) | HTR1BKCNH2NFKB1NFKB2RELA | |
| SCHEMBL14263999 | 0.84 | HTR1B (0.73) | HTR1BKCNH2NFKB1NFKB2RELA | |
| SCHEMBL14370170 | 0.84 | HTR1B (0.73) | HTR1BKCNH2NFKB1NFKB2RELA | |
| SCHEMBL5354642 | 0.84 | HTR1B (0.73) | HTR1BKCNH2NFKB1NFKB2RELA | |
| SCHEMBL22411092 | 0.75 | HTR1B (0.49) | HTR1BKCNH2NFKB1NFKB2RELA | |
| SCHEMBL5309051 | 0.75 | HTR1B (0.58) | HTR1BKCNH2NFKB1NFKB2RELA | |
| SCHEMBL5332970 | 0.74 | HTR1B (0.76) | HTR1BKCNH2NFKB1NFKB2RELA | |
| SCHEMBL4987894 | 0.74 | HTR1B (0.43) | HTR1BKCNH2ALDH1A1LMNATSHR |
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-2020183011-A1 | HTR1D INHIBITORS AND USES THEREOF IN THE TREATMENT OF CANCER | INSTITUT CURIE (FR) | 2020-09-17 | — | — | WO | disclosed |