Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | PNMT | P11086 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.42 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2154210 | 0.87 | SMN1; SMN2 (0.49) | SMN1; SMN2SLC6A2SLC6A4ALDH1A1KDM4E | |
| SCHEMBL6740216 | 0.80 | TAAR1 (0.71) | TAAR1PNMTIDO1SLC6A2SLC6A4 | |
| SCHEMBL11116103 | 0.79 | FFAR1 (0.43) | TAAR1SMN1; SMN2ALDH1A1KDM4ECYP19A1 | |
| SCHEMBL28248440 | 0.79 | CYP19A1 (0.46) | SMN1; SMN2SLC6A2SLC6A4ALDH1A1KDM4E | |
| SCHEMBL28248935 | 0.79 | CYP19A1 (0.46) | SMN1; SMN2SLC6A2SLC6A4ALDH1A1KDM4E | |
| SCHEMBL27786220 | 0.78 | SMN1; SMN2 (0.38) | SMN1; SMN2ALDH1A1KDM4ECYP19A1 | |
| SCHEMBL2507390 | 0.78 | FFAR1 (0.48) | SMN1; SMN2ALDH1A1KDM4ECYP19A1 | |
| SCHEMBL8707438 | 0.76 | TAAR1 (0.50) | TAAR1SMN1; SMN2SLC6A4ALDH1A1CYP19A1 | |
| SCHEMBL11116346 | 0.75 | BACE1 (0.50) | TAAR1SMN1; SMN2PNMTIDO1AOC3 | |
| SCHEMBL73332 | 0.75 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0115690-A1 | Dibenzocycloheptenylidenes | AMERICAN HOME PRODUCTS CORPORATION (US) | 1984-08-15 | — | — | EP | disclosed |