Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | TOP2A | P11388 | 1/20 | 0.33 |
| ▸ | AVPR1A | P37288 | 3/20 | 0.33 |
| ▸ | EHMT2 | Q96KQ7 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21788901 | 0.74 | LMNA (0.42) | TOP2AAVPR1AEHMT2CYP3A4SRC | |
| SCHEMBL21789249 | 0.73 | — | — | |
| SCHEMBL21777934 | 0.72 | TSHR (0.38) | AVPR1ACYP3A4MEN1ALDH1A1CYP1A2 | |
| SCHEMBL8447329 | 0.71 | CHRNB2 (0.41) | CYP3A4ALDH1A1GAA | |
| SCHEMBL21788880 | 0.68 | TOP2A (0.40) | TOP2AAVPR1ACYP3A4ALDH1A1CYP1A2 | |
| SCHEMBL16148176 | 0.68 | TSHR (0.38) | TOP2AAVPR1ACYP3A4MEN1ALDH1A1 | |
| SCHEMBL1712501 | 0.67 | NPC1 (0.45) | CYP3A4CES1MEN1ALDH1A1CYP1A2 | |
| SCHEMBL24165052 | 0.65 | ALDH1A1 (0.42) | CYP3A4MEN1ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL9433444 | 0.65 | L3MBTL1 (0.46) | CYP3A4CES1MEN1ALDH1A1CYP1A2 | |
| SCHEMBL28498515 | 0.65 | MAPK1 (0.50) | ALDH1A1KMT2AGAA |
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-2020047447-A1 | CARDIAC SARCOMERE INHIBITORS | CYTOKINETICS, INC. (US) | 2020-03-05 | — | — | WO | disclosed |