Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 2/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL11677514 | 0.84 | MAPT (0.53) | NPC1MAPTRAB9ATRPA1DRD2 | |
| SCHEMBL11872086 | 0.81 | KCNH2 (0.38) | OPRK1PDE4DPTGS2NPC1MAPT | |
| SCHEMBL11730430 | 0.80 | CTNNB1 (0.36) | NPC1MAPTRAB9ACNR1CTNNB1 | |
| SCHEMBL11797647 | 0.80 | HPGD (0.41) | TRPA1CYP3A4CTNNB1WNT3AHPGD | |
| SCHEMBL11813095 | 0.79 | GSK3B (0.44) | NPC1MAPTRAB9ATRPA1CTNNB1 | |
| SCHEMBL1040880 | 0.78 | PDE4D (0.39) | OPRK1PDE4DPTGS2MAPTHDAC1 | |
| SCHEMBL11819107 | 0.78 | L3MBTL1 (0.38) | PDE4DNPC1MAPTRAB9ACTNNB1 | |
| SCHEMBL11727641 | 0.77 | GSR (0.48) | MAPTSMN1; SMN2 | |
| SCHEMBL11750568 | 0.77 | L3MBTL1 (0.40) | NPC1MAPTRAB9ACTNNB1WNT3A | |
| SCHEMBL11869257 | 0.76 | PTGS2 (0.36) | OPRK1PDE4DPTGS2NPC1MAPT |
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-3957988-A | Antiviral compositions containing bis-basic ketones of thioxanthene | RICHARDSON-MERRELL INC. (US) | 1976-05-18 | — | — | US | disclosed |