Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CTSK | P43235 | 2/20 | 0.47 |
| ▸ | BTK | Q06187 | 2/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.42 |
| ▸ | HRH2 | P25021 | 4/20 | 0.42 |
| ▸ | HRH1 | P35367 | 4/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 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 | |
|---|---|---|---|---|
| SCHEMBL21584005 | 0.91 | CTSK (0.53) | CA1CA2CTSKBTKHRH2 | |
| SCHEMBL24036902 | 0.91 | CTSK (0.53) | CA1CA2CTSKBTKHRH2 | |
| SCHEMBL20689471 | 0.89 | CA1 (0.55) | CA1CA2CTSKBTKEPHX1 | |
| SCHEMBL20697344 | 0.89 | CA1 (0.55) | CA1CA2CTSKBTKEPHX1 | |
| SCHEMBL20089656 | 0.86 | CTSK (0.45) | CA1CA2CTSKBTKEPHX1 | |
| SCHEMBL31037360 | 0.84 | CA1 (0.55) | CA1CA2CTSKBTKEPHX1 | |
| SCHEMBL1700413 | 0.83 | CTSK (0.56) | CA1CA2CTSKBTKHRH2 | |
| SCHEMBL24690239 | 0.83 | KCNA3 (0.54) | CA1CA2CTSKBTKEPHX1 | |
| SCHEMBL1700415 | 0.83 | CTSK (0.56) | CA1CA2CTSKBTKHRH2 | |
| SCHEMBL1810659 | 0.83 | CTSK (0.56) | CA1CA2CTSKBTKHRH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021249533-A1 | ESTROGEN RECEPTOR MODULATOR COMPOUND AND USE THEREOF | 江苏先声药业有限公司 | 2021-12-16 | — | — | WO | disclosed |