Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCN4 | Q9Y3Q4 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9624761 | 0.99 | HCN4 (0.45) | HCN4MAPTCYP3A4ALOX15CHRM2 | |
| SCHEMBL9624720 | 0.97 | HCN4 (0.46) | HCN4MAPTCYP3A4ALOX15CHRM2 | |
| SCHEMBL9624425 | 0.95 | HCN4 (0.51) | HCN4MAPTCYP3A4ALOX15CHRM2 | |
| Hydrochloric Acid SCHEMBL9625697 | 0.94 | CYP3A4 (0.52) | HCN4MAPTCYP3A4ALOX15CHRM2 | |
| Hydrochloric Acid SCHEMBL9624321 | 0.94 | CYP3A4 (0.52) | HCN4MAPTCYP3A4ALOX15CHRM2 | |
| SCHEMBL9624963 | 0.87 | HDAC6 (0.34) | HCN4MAPTCYP3A4ALOX15DRD3 | |
| SCHEMBL9625068 | 0.86 | HDAC6 (0.35) | HCN4MAPTCYP3A4ALOX15DRD3 | |
| SCHEMBL9624708 | 0.85 | HCN4 (0.59) | HCN4MAPTCYP3A4ALOX15CHRM2 | |
| SCHEMBL10400846 | 0.85 | MAPT (0.40) | HCN4MAPTCYP3A4ALOX15ABCB1 | |
| Hydrochloric Acid SCHEMBL9624391 | 0.85 | CYP3A4 (0.59) | HCN4MAPTCYP3A4ALOX15CHRM2 |
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 |