Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA2 | Q9HCG7 | 2/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.40 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.40 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | GBA1 | P04062 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL26050348 | 0.90 | GBA2 (0.47) | GBA2NR1I2POLBCYP3A4CYP2D6 | |
| SCHEMBL4518775 | 0.90 | BCHE (0.37) | GBA2NR1I2OPRD1SMN1; SMN2KCNH2 | |
| SCHEMBL7700224 | 0.83 | ALDH1A1 (0.43) | SMN1; SMN2KMT2A | |
| SCHEMBL4523595 | 0.83 | SMN1; SMN2 (0.37) | GBA2OPRD1S1PR1S1PR3S1PR5 | |
| SCHEMBL26050252 | 0.80 | GBA1 (0.45) | GBA2SMN1; SMN2GBA1 | |
| SCHEMBL16207902 | 0.78 | SMN1; SMN2 (0.36) | SMN1; SMN2 | |
| SCHEMBL4514040 | 0.77 | BCHE (0.36) | SMN1; SMN2BCHE | |
| SCHEMBL2638664 | 0.77 | NR1I2 (0.55) | NR1I2OPRD1S1PR1S1PR3S1PR5 | |
| SCHEMBL8892725 | 0.77 | NR1I2 (0.55) | NR1I2OPRD1S1PR1S1PR3S1PR5 | |
| SCHEMBL13974938 | 0.77 | NR1I2 (0.55) | NR1I2OPRD1S1PR1S1PR3S1PR5 |
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-0600955-A1 | 5-HT4 RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-06-15 | — | — | EP | disclosed |
| WO-1993003725-A1 | 5-HT4 RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1993-03-04 | — | — | WO | disclosed |