Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCN4 | Q9Y3Q4 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 5/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.38 |
| ▸ | DRD3 | P35462 | 5/20 | 0.34 |
| ▸ | DRD2 | P14416 | 3/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.34 |
| ▸ | DRD4 | P21917 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | WDR5 | P61964 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9624233 | 0.94 | HCN4 (0.39) | HCN4MAPTCYP3A4ALOX15DRD3 | |
| SCHEMBL9625033 | 0.90 | ALDH1A1 (0.37) | HCN4MAPTCYP3A4ALOX15POLB | |
| SCHEMBL9624712 | 0.89 | MAPT (0.35) | HCN4MAPTCYP3A4ALOX15 | |
| SCHEMBL9624855 | 0.88 | HCN4 (0.44) | HCN4MAPTCYP3A4ALOX15MTNR1A | |
| SCHEMBL9624315 | 0.87 | ALOX15 (0.36) | HCN4MAPTCYP3A4ALOX15DRD2 | |
| SCHEMBL9624342 | 0.84 | MAPT (0.34) | HCN4MAPTCYP3A4ALOX15POLB | |
| SCHEMBL9624308 | 0.84 | HTR1A (0.48) | MAPTMTNR1AMTNR1BHTR1ASLC6A4 | |
| SCHEMBL9623729 | 0.83 | AOC3 (0.35) | HCN4MAPTCYP3A4ALOX15 | |
| SCHEMBL9624284 | 0.83 | KDM4E (0.36) | HCN4MAPTCYP3A4ALOX15DRD3 | |
| SCHEMBL9624455 | 0.83 | MAPT (0.39) | HCN4MAPTCYP3A4ALOX15POLB |
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 |