Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 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 | |
|---|---|---|---|---|
| SCHEMBL12460337 | 0.87 | — | — | |
| SCHEMBL3051330 | 0.77 | — | — | |
| SCHEMBL3050590 | 0.77 | — | — | |
| SCHEMBL10576267 | 0.76 | TSHR (0.41) | SHBGCHRM2CHRM1CHRM3 | |
| SCHEMBL149054 | 0.76 | TSHR (0.41) | SHBGCHRM2CHRM1CHRM3 | |
| SCHEMBL14217441 | 0.76 | SHBG (0.30) | SHBGCHRM2CHRM1CHRM3 | |
| SCHEMBL7739371 | 0.75 | CYP1A2 (0.48) | CHRM2CHRM1 | |
| SCHEMBL7739840 | 0.75 | CYP1A2 (0.48) | CHRM2CHRM1 | |
| SCHEMBL1145796 | 0.75 | CYP1A2 (0.48) | CHRM2CHRM1 | |
| SCHEMBL21134560 | 0.75 | SHBG (0.36) | SHBG |
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-9663521-B2 | Compounds and methods for the prevention and treatment of tumor metastasis and tumorigenesis | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2017-05-30 | — | — | US | disclosed |