Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.42 |
| ▸ | HCN4 | Q9Y3Q4 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 7/20 | 0.39 |
| ▸ | DRD4 | P21917 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 2/20 | 0.37 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 3/20 | 0.34 |
| ▸ | DRD1 | P21728 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9624248 | 0.89 | HDAC6 (0.35) | HCN4MAPTCYP3A4ALOX15GRM5 | |
| SCHEMBL9624387 | 0.88 | MAPT (0.39) | HRH3HCN4MAPTCYP3A4ALOX15 | |
| SCHEMBL9624665 | 0.87 | HCN4 (0.56) | HRH3HCN4MAPTCYP3A4ALOX15 | |
| SCHEMBL9624380 | 0.86 | MAPT (0.39) | HRH3HCN4MAPTCYP3A4ALOX15 | |
| Hydrochloric Acid SCHEMBL9624724 | 0.85 | CYP3A4 (0.40) | HRH3HCN4MAPTCYP3A4ALOX15 | |
| SCHEMBL9625087 | 0.84 | MAPT (0.43) | HRH3HCN4MAPTCYP3A4ALOX15 | |
| SCHEMBL10519444 | 0.82 | SIGMAR1 (0.54) | HRH3HCN4MAPTCYP3A4ALOX15 | |
| Hydrochloric Acid SCHEMBL10521565 | 0.82 | SIGMAR1 (0.53) | HRH3HCN4MAPTCYP3A4ALOX15 | |
| SCHEMBL9624157 | 0.81 | MAPT (0.39) | HCN4MAPTCYP3A4ALOX15DRD3 | |
| SCHEMBL9625005 | 0.81 | TERT (0.45) | HCN4MAPTCYP3A4ALOX15DRD3 |
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 |