Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 3/20 | 0.44 |
| ▸ | DRD4 | P21917 | 4/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 8/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 6/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | HTR1A | P08908 | 4/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.41 |
| ▸ | DRD2 | P14416 | 4/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.41 |
| ▸ | DRD1 | P21728 | 4/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.41 |
| ▸ | HTR2A | P28223 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.41 |
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 SCHEMBL5821459 | 0.99 | KDM1A (0.44) | KDM1ADRD4ADRA1AADRA1DADRA1B | |
| SCHEMBL5817869 | 0.92 | ADRA1A (0.51) | KDM1ADRD4ADRA1AADRA1DADRA1B | |
| SCHEMBL5805711 | 0.90 | KDM1A (0.55) | KDM1ADRD4ADRA1AADRA1DADRA1B | |
| Hydrochloric Acid SCHEMBL5807341 | 0.89 | KDM1A (0.54) | KDM1ADRD4ADRA1AADRA1DADRA1B | |
| SCHEMBL5816386 | 0.82 | DRD2 (0.56) | KDM1AADRA1AADRA1DADRA1BCYP3A4 | |
| SCHEMBL5809272 | 0.81 | KDM1A (0.63) | KDM1ADRD4ADRA1AADRA1DADRA1B | |
| Hydrochloric Acid SCHEMBL5809295 | 0.81 | KDM1A (0.62) | KDM1ADRD4ADRA1AADRA1DADRA1B | |
| SCHEMBL5821612 | 0.80 | KDM1A (0.53) | KDM1ADRD4ADRA1AADRA1DADRA1B | |
| Hydrochloric Acid SCHEMBL5821923 | 0.79 | KDM1A (0.52) | KDM1ADRD4ADRA1AADRA1DADRA1B | |
| SCHEMBL5816138 | 0.79 | DRD2 (0.52) | KDM1AHTR1ADRD2HTR2ADRD3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006117760-A1 | ADRENERGIC RECEPTOR ANTAGONISTS | RANBAXY LABORATORIES LIMITED (IN) | 2006-11-09 | — | — | WO | disclosed |