Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CEL | P19835 | 2/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | LDHA | P00338 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 3/20 | 0.33 |
| ▸ | HTR7 | P34969 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | LDHB | P07195 | 1/20 | 0.33 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.33 |
| ▸ | GCGR | P47871 | 1/20 | 0.33 |
| ▸ | PTPN5 | P54829 | 2/20 | 0.32 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3783301 | 0.84 | CEL (0.50) | CELOPRL1PTGDR2HTR1AHTR7 | |
| SCHEMBL3792040 | 0.82 | CEL (0.48) | CELOPRL1PTGDR2HTR1AHTR7 | |
| SCHEMBL9839711 | 0.81 | PTPN5 (0.40) | CELPTGDR2HTR1AHTR7PTGS2 | |
| SCHEMBL5887367 | 0.80 | PTGDR2 (0.41) | CELPTGDR2PTGS2 | |
| SCHEMBL24069104 | 0.79 | CEL (0.46) | CELOPRL1HTR1AHTR2A | |
| SCHEMBL126651 | 0.79 | CEL (0.46) | CELOPRL1HTR1AHTR2A | |
| SCHEMBL3789549 | 0.78 | CEL (0.44) | CELOPRL1HTR1AHTR7PTPN5 | |
| SCHEMBL7991827 | 0.77 | TSHR (0.45) | CELOPRL1PTGDR2PTPN5PTPN2 | |
| SCHEMBL10978822 | 0.76 | OPRL1 (0.61) | CELOPRL1HTR1APTGS2 | |
| SCHEMBL3793541 | 0.76 | CEL (0.43) | CELOPRL1PTGDR2HTR1AHTR7 |
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-4339611-A | BUTANOL, BUTANAL, COBALT, IODINE | GULF RESEARCH & DEVELOPMENT COMPANY (US) | 1982-07-13 | — | — | US | disclosed |