Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | HTR1A | P08908 | 2/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | DRD4 | P21917 | 1/20 | 0.49 |
| ▸ | HTR1D | P28221 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7401818 | 0.99 | MAPT (0.51) | MAPTHTR1ADRD2DRD4HTR1D | |
| SCHEMBL7403486 | 0.86 | DRD2 (0.50) | HTR1ADRD2DRD4HTR1DHTR2A | |
| SCHEMBL7397854 | 0.84 | DRD4 (0.68) | HTR1ADRD2DRD4HTR1DHTR2A | |
| Hydrochloric Acid SCHEMBL8185604 | 0.83 | DRD4 (0.67) | HTR1ADRD2DRD4HTR1DHTR2A | |
| SCHEMBL7405539 | 0.82 | ALDH1A1 (0.53) | MAPTHTR1ADRD2DRD4HTR1D | |
| SCHEMBL9052228 | 0.82 | DRD2 (0.47) | MAPTHTR1ADRD2DRD4HTR2A | |
| Hydrochloric Acid SCHEMBL8185523 | 0.81 | ALDH1A1 (0.52) | MAPTHTR1ADRD2DRD4HTR1D | |
| SCHEMBL27464824 | 0.80 | HTR2C (0.47) | HTR2CSIGMAR1 | |
| SCHEMBL7401217 | 0.80 | PARP1 (0.51) | MAPTDRD2DRD4HTR1DSIGMAR1 | |
| Hydrochloric Acid SCHEMBL7395941 | 0.79 | PARP1 (0.50) | MAPTDRD2DRD4HTR1DSIGMAR1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0737189-A1 | HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF CNS AND CARDIOVASCULAR DISORDERS | PHARMACIA & UPJOHN COMPANY (US) | 1996-10-16 | — | — | EP | claimed |
| WO-1995018118-A1 | HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF CNS AND CARDIOVASCULAR DISORDERS | THE UPJOHN COMPANY (US) | 1995-07-06 | — | — | WO | claimed |
| US-6133446-A | Heterocyclic compounds for the treatment of CNS and cardiovascular disorders | PHARMACIA & UPJOHN COMPANY (US) | 2000-10-17 | — | — | US | disclosed |
| EP-0737189-A1 | HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF CNS AND CARDIOVASCULAR DISORDERS | PHARMACIA & UPJOHN COMPANY (US) | 1996-10-16 | — | — | EP | disclosed |
| WO-1995018118-A1 | HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF CNS AND CARDIOVASCULAR DISORDERS | THE UPJOHN COMPANY (US) | 1995-07-06 | — | — | WO | disclosed |