Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.31 |
| ▸ | CTSL | P07711 | 1/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.30 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL329899 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL2052402 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL329900 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL3725588 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL12468506 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL1537604 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL13817962 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL5036319 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| Hydrochloric Acid SCHEMBL7644054 | 0.99 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| Hydrochloric Acid SCHEMBL1536344 | 0.99 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2033654-A1 | Macrocyclic isoquinoline peptide inhibitors of hepatitis c virus | Bristol-Myers Squibb Company (US) | 2009-03-11 | — | — | EP | disclosed |