Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9624289 | 0.91 | CYP2D6 (0.37) | GPR84CYP2D6CYP3A4KMT2A | |
| SCHEMBL9624352 | 0.84 | HCN4 (0.44) | GPR84CYP3A4 | |
| SCHEMBL9624625 | 0.82 | ALDH1A1 (0.41) | ALDH1A1GAAMAPK1KMT2A | |
| SCHEMBL9624482 | 0.82 | TDP1 (0.34) | CYP2D6 | |
| SCHEMBL9623778 | 0.81 | EDNRB (0.36) | CYP2D6CYP3A4ALDH1A1GAAMAPK1 | |
| SCHEMBL9624809 | 0.80 | RAB9A (0.34) | CYP2D6 | |
| SCHEMBL9625241 | 0.79 | ALDH1A1 (0.36) | CYP2D6CYP1A2CYP3A4ALDH1A1MAPK1 | |
| SCHEMBL9624353 | 0.79 | SMN1; SMN2 (0.39) | — | |
| SCHEMBL9623839 | 0.79 | ALDH1A1 (0.41) | ALDH1A1GAAMAPK1KMT2A | |
| SCHEMBL9624157 | 0.77 | MAPT (0.39) | GPR84CYP3A4 |
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 |