Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 2/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | HTR2C | P28335 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL24228697 | 0.86 | CYP19A1 (0.57) | CYP19A1ALDH1A1SMN1; SMN2TP53CYP1A2 | |
| SCHEMBL9431516 | 0.84 | CYP19A1 (0.56) | CYP19A1ALDH1A1SMN1; SMN2TP53CYP1A2 | |
| SCHEMBL6689014 | 0.81 | CYP19A1 (0.61) | CYP19A1ALDH1A1SMN1; SMN2TP53CYP1A2 | |
| SCHEMBL6694407 | 0.81 | CYP19A1 (0.61) | CYP19A1ALDH1A1SMN1; SMN2TP53CYP1A2 | |
| SCHEMBL2325962 | 0.79 | MTNR1A (0.50) | CYP19A1SIGMAR1 | |
| SCHEMBL8756180 | 0.78 | CYP19A1 (0.58) | CYP19A1ALDH1A1SMN1; SMN2TP53CYP1A2 | |
| SCHEMBL8668547 | 0.78 | CYP19A1 (0.58) | CYP19A1ALDH1A1SMN1; SMN2TP53CYP1A2 | |
| SCHEMBL31296097 | 0.77 | CYP19A1 (0.57) | CYP19A1ALDH1A1SMN1; SMN2TP53CYP1A2 | |
| SCHEMBL7672871 | 0.77 | CYP19A1 (0.57) | CYP19A1ALDH1A1SMN1; SMN2TP53CYP1A2 | |
| SCHEMBL8489825 | 0.77 | CYP19A1 (0.57) | CYP19A1HTR1ASIGMAR1ACHEHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| US-5847159-A | 1- ω-(3,4-dihydro-2-naphthalenyl)alkyl!-cyclic amine derivatives, process for preparing the same, and pharmaceutical composition containing the same | DAINIPPON PHARMACEUTICAL CO., LTD. (JP) | 1998-12-08 | — | — | US | disclosed |