Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.45 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9623814 | 0.96 | SIGMAR1 (0.41) | SIGMAR1CHRNA7DRD2ABCB1ABCG2 | |
| SCHEMBL9624715 | 0.88 | SIGMAR1 (0.45) | SIGMAR1CHRNA7ABCB1ABCG2 | |
| SCHEMBL9624421 | 0.85 | ABCB1 (0.54) | SIGMAR1ABCB1ABCG2MAPT | |
| SCHEMBL9624273 | 0.84 | SIGMAR1 (0.42) | SIGMAR1CHRNA7ABCB1ABCG2 | |
| SCHEMBL9624316 | 0.81 | GNRHR (0.45) | SIGMAR1DRD2KDM4E | |
| SCHEMBL9624977 | 0.81 | ABCB1 (0.54) | SIGMAR1ABCB1ABCG2 | |
| SCHEMBL9624944 | 0.81 | MAPT (0.41) | CHRNA7KDM4EMAPK1ALDH1A1GAA | |
| SCHEMBL9624635 | 0.80 | CHRNA7 (0.49) | SIGMAR1CHRNA7KDM4EALDH1A1 | |
| SCHEMBL9623839 | 0.79 | ALDH1A1 (0.41) | CHRNA7KDM4EMAPK1ALDH1A1GAA | |
| SCHEMBL9625109 | 0.77 | ALOX15 (0.39) | CHRNA7KDM4EMAPK1ALDH1A1GAA |
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 |