Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 4/20 | 0.61 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.60 |
| ▸ | BRD1 | O95696 | 1/20 | 0.60 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.60 |
| ▸ | PKLR | P30613 | 1/20 | 0.55 |
| ▸ | HTR2C | P28335 | 2/20 | 0.54 |
| ▸ | HTR6 | P50406 | 2/20 | 0.54 |
| ▸ | DRD2 | P14416 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 1/20 | 0.54 |
| ▸ | DRD3 | P35462 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | HTR2B | P41595 | 1/20 | 0.51 |
| ▸ | BRD4 | O60885 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3350485 | 0.88 | PNMT (0.54) | PNMTTRIM24BRD1BRPF1PKLR | |
| SCHEMBL13757810 | 0.88 | PNMT (0.62) | PNMTHTR2CHTR6DRD2HTR2A | |
| Hydrochloric Acid SCHEMBL9957225 | 0.87 | PNMT (0.61) | PNMTHTR2CHTR6DRD2HTR2A | |
| SCHEMBL3353744 | 0.84 | PKLR (0.65) | PNMTTRIM24BRD1BRPF1PKLR | |
| SCHEMBL13757776 | 0.84 | PNMT (0.76) | PNMTHTR2CHTR6DRD2HTR2A | |
| Hydrochloric Acid SCHEMBL9958844 | 0.82 | PNMT (0.74) | PNMTHTR2CHTR6DRD2HTR2A | |
| SCHEMBL10239988 | 0.80 | PKM (0.67) | PNMTTRIM24BRD1BRPF1PKLR | |
| Hydrochloric Acid SCHEMBL9957679 | 0.79 | PKM (0.66) | PNMTTRIM24BRD1BRPF1PKLR | |
| SCHEMBL13757806 | 0.79 | HTT (0.63) | PNMTTRIM24BRD1BRPF1HTR2C | |
| Hydrochloric Acid SCHEMBL9958694 | 0.78 | HTT (0.62) | PNMTTRIM24BRD1BRPF1HTR2C |
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 |
|---|---|---|---|---|---|---|---|
| EP-2007729-B1 | SUBSTITUTED TETRAHYDROISOQUINOLINE COMPOUNDS, THEIR PREPARATION AND USE IN MEDICAMENTS | ESTEVE LABOR DR (ES) | 2012-06-27 | — | — | EP | disclosed |