Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC2A1 | P11166 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.31 |
| ▸ | CCR4 | P51679 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | EBP | Q15125 | 1/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL27590555 | 0.80 | MTNR1A (0.34) | ALDH1A1CYP3A4LMNAKCNH2HRH3 | |
| SCHEMBL27590523 | 0.67 | BCHE (0.30) | — | |
| SCHEMBL27590556 | 0.65 | NISCH (0.36) | ALDH1A1CYP3A4ABCG2KCNH2HRH3 | |
| SCHEMBL27609146 | 0.60 | — | — | |
| SCHEMBL2149694 | 0.60 | MAPT (0.41) | KDM4EALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL27590701 | 0.60 | NISCH (0.32) | — | |
| SCHEMBL5937106 | 0.60 | ABCB1 (0.39) | KDM4EALDH1A1CYP3A4HPGDMAPK1 | |
| SCHEMBL27608946 | 0.59 | ERN1 (0.37) | SLC2A1KDM4EERN1ALDH1A1CYP3A4 | |
| SCHEMBL27719867 | 0.57 | — | — | |
| 2,4,6-Trimethoxybenzaldehyde SCHEMBL34873 | 0.54 | ERN1 (0.74) | KDM4EERN1ALDH1A1CYP3A4ABCG2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1561212-A | Benzimidazolone Derivatives as Muscarinic Agents | ACADIA PHARM INC (US) | 2005-01-05 | — | — | CN | disclosed |