Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 1/20 | 0.35 |
| ▸ | GPBAR1 | Q8TDU6 | 7/20 | 0.35 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.34 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.33 |
| ▸ | LTC4S | Q16873 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14743624 | 0.89 | GPBAR1 (0.38) | ACLYGPBAR1HPGDHTTL3MBTL1 | |
| SCHEMBL14743489 | 0.84 | GAA (0.41) | ACLYGPBAR1NPC1RAB9AL3MBTL1 | |
| SCHEMBL14743375 | 0.83 | GPBAR1 (0.39) | ACLYGPBAR1 | |
| SCHEMBL14743590 | 0.81 | GPBAR1 (0.40) | GPBAR1ALDH1A1 | |
| SCHEMBL14744302 | 0.81 | ACLY (0.46) | ACLYGPBAR1NPC1ALDH1A1MAPT | |
| SCHEMBL14743459 | 0.81 | ACLY (0.36) | ACLYGPBAR1HCAR1NR1H4NPC1 | |
| SCHEMBL14743263 | 0.80 | KDM4E (0.38) | ACLYGPBAR1NR1H4NPC1ALDH1A1 | |
| SCHEMBL14743723 | 0.80 | KDM4E (0.47) | ACLYGPBAR1 | |
| SCHEMBL14743805 | 0.79 | GPBAR1 (0.43) | GPBAR1NPC1ALDH1A1HTTRAB9A | |
| SCHEMBL14743638 | 0.76 | CYP1A2 (0.35) | ACLYGPBAR1ALDH1A1MAPT |
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-2013030358-A1 | GLYCINE B ANTAGONISTS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2013-03-07 | — | — | WO | disclosed |