Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCN4 | Q9Y3Q4 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | DRD5 | P21918 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL9624764 | 0.96 | HCN4 (0.46) | HCN4MAPTCYP3A4ALOX15ABCB1 | |
| SCHEMBL9625187 | 0.87 | HDAC6 (0.36) | HCN4MAPTCYP3A4ALOX15ALDH1A1 | |
| SCHEMBL9625241 | 0.84 | ALDH1A1 (0.36) | MAPTCYP3A4ALOX15ALDH1A1POLB | |
| SCHEMBL9624774 | 0.82 | HDAC6 (0.36) | HCN4MAPTCYP3A4ALOX15ALDH1A1 | |
| SCHEMBL10667392 | 0.82 | HCN4 (0.67) | HCN4MAPTCYP3A4ALOX15ABCB1 | |
| SCHEMBL9623723 | 0.82 | HCN4 (0.46) | HCN4MAPTCYP3A4ALOX15ABCB1 | |
| SCHEMBL9624245 | 0.82 | HCN4 (0.44) | HCN4MAPTCYP3A4ALOX15ABCB1 | |
| SCHEMBL9624246 | 0.80 | HCN4 (0.46) | HCN4MAPTCYP3A4ALOX15ABCB1 | |
| SCHEMBL9624420 | 0.80 | ALDH1A1 (0.36) | MAPTCYP3A4ALOX15ALDH1A1POLB | |
| SCHEMBL9624484 | 0.80 | HCN4 (0.51) | HCN4MAPTCYP3A4ALOX15ABCB1 |
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 |
| US-4912115-A | Cardiovascular disorders | DR. KARL THOMAE GMBH (DE) | 1990-03-27 | — | — | US | disclosed |