Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | MLYCD | O95822 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | BACE1 | P56817 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL4738587 | 0.85 | TSHR (0.43) | ACHEMLYCDTSHRHTTALDH1A1 | |
| SCHEMBL4840795 | 0.84 | PPARG (0.41) | MLYCDTSHRHTTALDH1A1KDM4E | |
| SCHEMBL3894800 | 0.80 | TSHR (0.42) | MLYCDTSHRHTTALDH1A1KDM4E | |
| SCHEMBL2552511 | 0.79 | TSHR (0.41) | MLYCDTSHRHTTALDH1A1KDM4E | |
| SCHEMBL572741 | 0.79 | ALDH1A1 (0.59) | TSHRHTTALDH1A1CYP2C19GLA | |
| SCHEMBL4838461 | 0.78 | ALDH1A1 (0.47) | MLYCDTSHRHTTALDH1A1CYP2A6 | |
| SCHEMBL12719411 | 0.78 | ALDH1A1 (0.42) | TSHRHTTALDH1A1GLA | |
| SCHEMBL2312956 | 0.77 | LMNA (0.39) | AOC3TAAR1ACHEALDH1A1BACE1 | |
| SCHEMBL16640701 | 0.77 | NR1H4 (0.38) | — | |
| SCHEMBL2318201 | 0.77 | ACHE (0.41) | TAAR1ACHEHTTALDH1A1BACE1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1794135-A1 | SUBSTITUTED HETEROCYCLIC COMPOUNDS AND METHODS OF USE | Amgen Inc. (US) | 2007-06-13 | — | — | EP | disclosed |
| WO-2006037117-A1 | SUBSTITUTED HETEROCYCLIC COMPOUNDS AND METHODS OF USE | AMGEN INC. (US) | 2006-04-06 | — | — | WO | disclosed |