Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.40 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6560519 | 0.83 | GABRA1 (0.42) | ESR1SMN1; SMN2ALDH1A1SLC6A2NR3C2 | |
| SCHEMBL18924413 | 0.82 | MME (0.39) | ESR1SMN1; SMN2L3MBTL1ALDH1A1RAB9A | |
| SCHEMBL17000195 | 0.79 | POLB (0.44) | SMN1; SMN2SLC6A2PGRADORA3PTGS1 | |
| SCHEMBL22485951 | 0.79 | NR3C2 (0.41) | SMN1; SMN2ALDH1A1SLC6A2NR3C2PGR | |
| SCHEMBL13561354 | 0.79 | HTR2B (0.43) | ESR1SMN1; SMN2L3MBTL1ALDH1A1RAB9A | |
| SCHEMBL21443572 | 0.79 | SREBF2 (0.41) | SMN1; SMN2L3MBTL1ALDH1A1RAB9ATDP1 | |
| SCHEMBL22911519 | 0.78 | PGR (0.46) | SMN1; SMN2L3MBTL1ALDH1A1SLC6A2PGR | |
| SCHEMBL13562418 | 0.78 | NOS2 (0.53) | SMN1; SMN2L3MBTL1ALDH1A1RAB9ATDP1 | |
| SCHEMBL5115091 | 0.78 | RECQL (0.50) | SMN1; SMN2L3MBTL1ALDH1A1RAB9ATDP1 | |
| SCHEMBL23863910 | 0.78 | GABRA1 (0.39) | SMN1; SMN2ALDH1A1SLC6A2NR3C2PGR |
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 |
|---|---|---|---|---|---|---|---|
| US-9670172-B2 | Heterocyclic compounds and methods of use | MEDIVATION TECHNOLOGIES, INC. (US) | 2017-06-06 | — | — | US | disclosed |