Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.39 |
| ▸ | SELE | P16581 | 1/20 | 0.39 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | F10 | P00742 | 1/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL17508487 | 0.85 | BCHE (0.43) | BCHEACHEMAPTABCG2L3MBTL1 | |
| SCHEMBL17508472 | 0.74 | HPGD (0.47) | MAPTABCG2L3MBTL1NPSR1CYP1A2 | |
| SCHEMBL8941708 | 0.70 | AR (0.54) | MAPTABCG2L3MBTL1NPSR1CYP1A2 | |
| SCHEMBL9798371 | 0.70 | LTA4H (0.54) | MAPTABCG2L3MBTL1NPSR1CYP1A2 | |
| SCHEMBL11960608 | 0.70 | ACHE (0.62) | BCHEACHE | |
| SCHEMBL6791603 | 0.69 | RXFP1 (0.58) | CYP2C19THRATHRBKDM4EALDH1A1 | |
| SCHEMBL30775042 | 0.69 | RXFP1 (0.58) | CYP2C19THRATHRBKDM4EALDH1A1 | |
| SCHEMBL9546526 | 0.69 | L3MBTL1 (0.55) | ABCG2L3MBTL1NPSR1CYP1A2CYP2C9 | |
| SCHEMBL9590802 | 0.68 | AR (0.51) | MAPTABCG2L3MBTL1NPSR1CYP1A2 | |
| SCHEMBL9589393 | 0.68 | AR (0.51) | MAPTABCG2L3MBTL1NPSR1CYP1A2 |
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-2016021742-A1 | HETEROCYCLIC COMPOUNDS AS EP4 RECEPTOR ANTAGONISTS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-02-11 | — | — | WO | disclosed |