Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL13275099 | 0.88 | CASR (0.36) | HDAC1HDAC8HDAC6MCHR1SMN1; SMN2 | |
| SCHEMBL2349823 | 0.87 | ENPP2 (0.32) | — | |
| SCHEMBL2361416 | 0.87 | ENPP2 (0.34) | — | |
| SCHEMBL2222897 | 0.87 | SMN1; SMN2 (0.36) | HDAC1HDAC8HDAC6MCHR1SMN1; SMN2 | |
| SCHEMBL2266173 | 0.85 | HDAC1 (0.32) | HDAC1HDAC8HDAC6MCHR1SMN1; SMN2 | |
| SCHEMBL13506838 | 0.84 | ENPP2 (0.34) | — | |
| SCHEMBL2365229 | 0.83 | CCNC (0.34) | — | |
| SCHEMBL2221295 | 0.83 | BRD4 (0.34) | — | |
| SCHEMBL2269504 | 0.82 | CREBBP (0.34) | — | |
| SCHEMBL2221688 | 0.82 | OPRM1 (0.31) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011084402-A1 | TYROSINE KINASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2011-07-14 | — | — | WO | claimed |
| WO-2011084402-A1 | TYROSINE KINASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2011-07-14 | — | — | WO | disclosed |