Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 3/20 | 0.48 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.48 |
| ▸ | PDE2A | O00408 | 2/20 | 0.47 |
| ▸ | SPR | P35270 | 1/20 | 0.43 |
| ▸ | CYP46A1 | Q9Y6A2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 2/20 | 0.42 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | RORC | P51449 | 1/20 | 0.42 |
| ▸ | FASN | P49327 | 1/20 | 0.41 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.41 |
| ▸ | CPS1 | P31327 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23734996 | 1.00 | HCRTR1 (0.48) | HCRTR1HCRTR2PDE2ASPRCYP46A1 | |
| SCHEMBL22735368 | 0.82 | CYP46A1 (0.54) | HCRTR1HCRTR2PDE2ACYP46A1ALDH1A1 | |
| SCHEMBL15473451 | 0.80 | KMT2A (0.57) | ALDH1A1HPGDPARP1L3MBTL3PARP2 | |
| SCHEMBL12947988 | 0.80 | KMT2A (0.57) | ALDH1A1HPGDPARP1L3MBTL3PARP2 | |
| SCHEMBL22735458 | 0.80 | HCRTR1 (0.48) | HCRTR1HCRTR2PDE2ASPRCYP46A1 | |
| SCHEMBL16124835 | 0.79 | HSD11B1 (0.44) | HCRTR1HCRTR2SPRALDH1A1HPGD | |
| SCHEMBL16124836 | 0.79 | HSD11B1 (0.44) | HCRTR1HCRTR2SPRALDH1A1HPGD | |
| SCHEMBL18065198 | 0.79 | HSD11B1 (0.44) | HCRTR1HCRTR2SPRALDH1A1HPGD | |
| SCHEMBL14028153 | 0.79 | HPGD (0.61) | HCRTR1HCRTR2CYP46A1ALDH1A1HPGD | |
| SCHEMBL7870105 | 0.78 | CPS1 (0.55) | PDE2ACYP46A1ALDH1A1PARP1CPS1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3594202-B1 | SUBSTITUTED PYRROLIDINE COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICALS CO (JP) | 2021-08-11 | — | — | EP | disclosed |