Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPR | P35270 | 2/20 | 0.48 |
| ▸ | CCR5 | P51681 | 4/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23734784 | 0.88 | ALDH1A1 (0.51) | SPREPHX2KMT2A | |
| SCHEMBL23734850 | 0.86 | SMN1; SMN2 (0.48) | SPREPHX2HCRTR1HCRTR2KMT2A | |
| SCHEMBL23734774 | 0.85 | SPR (0.46) | SPRCCR5OPRK1KCNH2 | |
| SCHEMBL22735458 | 0.84 | HCRTR1 (0.48) | SPREPHX2HCRTR1HCRTR2KMT2A | |
| SCHEMBL22735588 | 0.84 | HTT (0.51) | EPHX2KMT2AMEN1HRH3OPRK1 | |
| SCHEMBL23734969 | 0.84 | HTT (0.51) | EPHX2KMT2AMEN1HRH3OPRK1 | |
| SCHEMBL22771999 | 0.83 | SLC6A2 (0.48) | SPRCCR5KMT2A | |
| SCHEMBL596167 | 0.82 | OPRK1 (0.44) | SPREPHX2CHRM3KMT2AMEN1 | |
| SCHEMBL596166 | 0.82 | OPRK1 (0.44) | SPREPHX2CHRM3KMT2AMEN1 | |
| SCHEMBL23734990 | 0.80 | HCRTR1 (0.42) | CCR5HCRTR1HCRTR2KMT2AOPRK1 |
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-3594202-B1 | SUBSTITUTED PYRROLIDINE COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICALS CO (JP) | 2021-08-11 | — | — | EP | disclosed |
| EP-3594202-B1 | SUBSTITUTED PYRROLIDINE COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICALS CO (JP) | 2021-08-11 | — | — | EP | disclosed |