Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 4/20 | 0.51 |
| ▸ | HTR7 | P34969 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.47 |
| ▸ | HTR3B | O95264 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | THPO | P40225 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.47 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.47 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6232220 | 0.84 | ALDH1A1 (0.53) | ALDH1A1LMNAHTR1ARAB9AHTR3E | |
| SCHEMBL6232309 | 0.83 | CTSB (0.55) | ALDH1A1LMNAHTR1AHTR3EHTR3B | |
| SCHEMBL6231556 | 0.83 | HTR1A (0.51) | ALDH1A1HTR1AHTR7HTR3EHTR3B | |
| SCHEMBL6230633 | 0.83 | ALDH1A1 (0.55) | ALDH1A1LMNAHTR1ARAB9AHTR3E | |
| SCHEMBL5766028 | 0.82 | TRPV6 (0.49) | ALDH1A1HTR1AMAPK1RAB9AHTR3E | |
| SCHEMBL6232343 | 0.80 | MCHR1 (0.48) | ALDH1A1LMNAMAPK1MCHR1 | |
| SCHEMBL10365458 | 0.79 | ALDH1A1 (0.46) | ALDH1A1LMNAHTR1AHTR3EHTR3B | |
| SCHEMBL3151686 | 0.75 | POLB (0.71) | ALDH1A1LMNAL3MBTL1POLBMCHR1 | |
| SCHEMBL6862211 | 0.74 | MEN1 (0.65) | ALDH1A1LMNAHTR7L3MBTL1MAPK1 | |
| SCHEMBL6233604 | 0.74 | MCHR1 (0.49) | ALDH1A1HTR1APOLBHTR3EHTR3B |
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-2004092181-A9 | HETEROCYCLIC MCHR1 ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2005-01-27 | — | — | WO | disclosed |