Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HCN4 | Q9Y3Q4 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.39 |
| ▸ | SMPD1 | P17405 | 5/20 | 0.38 |
| ▸ | DRD3 | P35462 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | DRD5 | P21918 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10400953 | 0.90 | MAPT (0.39) | MAPTHCN4CYP3A4ALOX15ABCB1 | |
| SCHEMBL9625705 | 0.88 | DRD2 (0.39) | SMPD1DRD3DRD2KCNH2 | |
| SCHEMBL9624347 | 0.85 | DRD2 (0.38) | DRD3DRD2KCNH2 | |
| SCHEMBL10673967 | 0.84 | HCN4 (0.65) | MAPTHCN4CYP3A4ALOX15ABCB1 | |
| SCHEMBL9624318 | 0.83 | MAPT (0.44) | MAPTHCN4CYP3A4ALOX15ABCB1 | |
| SCHEMBL9624752 | 0.83 | HCN4 (0.46) | MAPTHCN4CYP3A4ALOX15ABCB1 | |
| SCHEMBL9624246 | 0.83 | HCN4 (0.46) | MAPTHCN4CYP3A4ALOX15ABCB1 | |
| Hydrochloric Acid SCHEMBL9624740 | 0.82 | ALOX15 (0.47) | MAPTHCN4CYP3A4ALOX15ABCB1 | |
| SCHEMBL9624293 | 0.82 | HCN4 (0.46) | MAPTHCN4CYP3A4ALOX15ABCB1 | |
| SCHEMBL9624854 | 0.81 | MAPT (0.44) | MAPTHCN4CYP3A4ALOX15ABCB1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5116986-A | HETEROAROMATIC AMINE DERIVATIVES | DR. KARL THOMAE GMBH (DE) | 1992-05-26 | — | — | US | disclosed |
| EP-0269968-A2 | Heteroaromatic amine derivatives, medicaments containing them and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-06-08 | — | — | EP | disclosed |