Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.35 |
| ▸ | DAO | P14920 | 1/20 | 0.35 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.34 |
| ▸ | GPR3 | P46089 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29954943 | 0.84 | PDE2A (0.41) | PDE2AALDH1A1MAPTMCL1TSHR | |
| SCHEMBL29956335 | 0.80 | PTPN5 (0.34) | PDE2AMAPTAHRTSHRL3MBTL1 | |
| SCHEMBL12169318 | 0.80 | CYP2C19 (0.39) | PDE2AALDH1A1MAPTTSHRMEN1 | |
| SCHEMBL29956599 | 0.78 | AR (0.46) | PDE2APTPN5GPR3 | |
| SCHEMBL29643300 | 0.76 | PTPN5 (0.34) | PDE2AALDH1A1TSHRPTPN5GPR3 | |
| SCHEMBL29955691 | 0.73 | IDO1 (0.41) | PDE2AAHRTSHRMEN1KMT2A | |
| SCHEMBL29956146 | 0.73 | CES2 (0.46) | PDE2AALDH1A1TSHRPTPN5GPR3 | |
| SCHEMBL980201 | 0.73 | TSHR (0.61) | PDE2AALDH1A1MAPTMCL1AHR | |
| SCHEMBL29402881 | 0.73 | TSHR (0.61) | PDE2AALDH1A1MAPTMCL1AHR | |
| SCHEMBL12138250 | 0.72 | NISCH (0.33) | ALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |