Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 10/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 10/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1531197 | 0.68 | HCAR2 (0.42) | AKR1C3AKR1C2AKR1C1PTGS1LMNA | |
| SCHEMBL7260977 | 0.67 | AKR1C3 (0.37) | AKR1C3AKR1C2AKR1C1PTGS1HTR1A | |
| SCHEMBL1083618 | 0.66 | KMT2A (0.42) | AKR1C3AKR1C2AKR1C1PTGS1POLB | |
| SCHEMBL18769064 | 0.66 | CPB2 (0.62) | — | |
| SCHEMBL29875286 | 0.65 | ALOX5 (0.50) | AKR1C3AKR1C2GAALMNAHSD17B10 | |
| SCHEMBL907718 | 0.65 | HCAR3 (0.34) | AKR1C3AKR1C2AKR1C1PTGS1POLB | |
| SCHEMBL977577 | 0.65 | ALOX5 (0.50) | AKR1C3AKR1C2GAALMNAHSD17B10 | |
| SCHEMBL1574429 | 0.65 | AKR1C3 (0.58) | AKR1C3AKR1C2AKR1C1PTGS1HTR1A | |
| SCHEMBL11983438 | 0.63 | SMN1; SMN2 (0.37) | AKR1C3AKR1C2AKR1C1PTGS1HTR1A | |
| SCHEMBL895966 | 0.63 | LMNA (0.40) | AKR1C3AKR1C2AKR1C1PTGS1GAA |
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-1953148-B1 | HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL (JP) | 2012-02-29 | — | — | EP | disclosed |
| US-7915267-B2 | Heterocyclic amide compound and use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-03-29 | — | — | US | disclosed |