Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA9 | Q16790 | 3/20 | 0.40 |
| ▸ | NAMPT | P43490 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP14 | P50281 | 1/20 | 0.39 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA4 | P22748 | 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 | |
|---|---|---|---|---|
| SCHEMBL9968024 | 0.85 | SLC6A2 (0.45) | PKMSLC6A2SLC6A4SLC6A3CYP19A1 | |
| SCHEMBL9968023 | 0.84 | SLC6A2 (0.41) | PKMSLC6A2SLC6A4SLC6A3CYP19A1 | |
| SCHEMBL9968581 | 0.84 | KDM4E (0.43) | SLC6A2SLC6A4SLC6A3CYP19A1ALDH1A1 | |
| SCHEMBL9968571 | 0.84 | SLC22A12 (0.43) | SLC6A2SLC6A4SLC6A3CYP19A1NAMPT | |
| SCHEMBL9968569 | 0.82 | MAPK1 (0.44) | PKMSLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL9941878 | 0.81 | MAPT (0.61) | PKMALDH1A1KMT2AHTT | |
| SCHEMBL9941726 | 0.72 | TSHR (0.61) | PKMALDH1A1KMT2AHTT | |
| SCHEMBL26536708 | 0.71 | ALDH1A1 (0.52) | ALDH1A1CA1CA2CA9KMT2A | |
| SCHEMBL15682729 | 0.71 | MEP1B (0.55) | CYP19A1ALDH1A1CA1CA2CA9 | |
| SCHEMBL29087314 | 0.69 | SMN1; SMN2 (0.59) | SLC6A2SLC6A4SLC6A3CYP19A1ALDH1A1 |
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-2012082862-A2 | ANDROGEN RECEPTOR INHIBITORS AND METHODS OF USE THEREOF | BETH ISRAEL DEACONESS MEDICAL CENTER (US) | 2012-06-21 | — | — | WO | disclosed |