Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | ATM | Q13315 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16723104 | 0.81 | GAA (0.35) | TSHRSMN1; SMN2GAA | |
| SCHEMBL16723162 | 0.81 | IDH1 (0.37) | ALDH1A1TSHRSMN1; SMN2GAA | |
| SCHEMBL16723222 | 0.78 | TSHR (0.36) | HSD11B1KMT2AMEN1TSHRSMN1; SMN2 | |
| SCHEMBL16723246 | 0.75 | TSHR (0.64) | HSD11B1ALDH1A1TSHRGAALMNA | |
| SCHEMBL16723238 | 0.72 | SMN1; SMN2 (0.41) | ALDH1A1KMT2AMEN1TSHRSMN1; SMN2 | |
| SCHEMBL16723156 | 0.69 | HCRTR2 (0.34) | ALDH1A1KMT2AMEN1GAA | |
| SCHEMBL16723230 | 0.69 | TSHR (0.37) | TSHRGAA | |
| SCHEMBL21086461 | 0.67 | HSD11B1 (0.46) | HSD11B1ALDH1A1ATMTP53KMT2A | |
| SCHEMBL3846913 | 0.66 | HPGD (0.53) | HSD11B1ALDH1A1ATMTP53KMT2A | |
| SCHEMBL22549651 | 0.66 | HPGD (0.53) | HSD11B1ALDH1A1ATMTP53KMT2A |
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-2015074081-A1 | BENZOPIPERAZINE COMPOSITIONS AS BET BROMODOMAIN INHIBITORS | BAIR KENNETH W (US) | 2015-05-21 | — | — | WO | disclosed |