Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 5/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.47 |
| ▸ | HTR1A | P08908 | 6/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HCN4 | Q9Y3Q4 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 3/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.40 |
| ▸ | HTR1D | P28221 | 2/20 | 0.40 |
| ▸ | HTR1B | P28222 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | HTR1E | P28566 | 2/20 | 0.40 |
| ▸ | HTR7 | P34969 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | HTR5A | P47898 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9624897 | 0.90 | HTR1A (0.52) | SLC6A4SLC6A2SLC6A3HTR1AMAPT | |
| SCHEMBL9624327 | 0.90 | MAPT (0.46) | SLC6A4SLC6A2SLC6A3HTR1APDE4D | |
| SCHEMBL9624830 | 0.89 | CDK4 (0.46) | HTR1APDE4DMAPTHCN4CYP3A4 | |
| SCHEMBL9624212 | 0.89 | SLC6A4 (0.48) | SLC6A4SLC6A2SLC6A3HTR1AMAPT | |
| Hydrochloric Acid SCHEMBL9625229 | 0.88 | CDK4 (0.46) | HTR1APDE4DMAPTHCN4CYP3A4 | |
| SCHEMBL9625146 | 0.86 | SLC6A4 (0.46) | SLC6A4SLC6A2SLC6A3HTR1AHTR6 | |
| SCHEMBL9625061 | 0.85 | PDE4D (0.47) | SLC6A4HTR1APDE4DMAPTCYP3A4 | |
| SCHEMBL10645698 | 0.85 | HCN4 (0.61) | SLC6A4SLC6A2SLC6A3HTR1APDE4D | |
| Hydrochloric Acid SCHEMBL9625271 | 0.84 | PDE4D (0.46) | SLC6A4HTR1APDE4DMAPTCYP3A4 | |
| SCHEMBL9624534 | 0.84 | HTR1D (0.55) | SLC6A4MAPTHTR6HTR1DKMT2A |
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 3 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 |
| US-4912115-A | Cardiovascular disorders | DR. KARL THOMAE GMBH (DE) | 1990-03-27 | — | — | 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 |