Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 7/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.49 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.49 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.49 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.49 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.49 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.49 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.44 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4832864 | 0.89 | HDAC1 (0.44) | HDAC1HDAC6HDAC2HDAC7HDAC8 | |
| SCHEMBL1844466 | 0.76 | SMN1; SMN2 (0.50) | NPC1RAB9AKMT2AMEN1TP53 | |
| SCHEMBL7734069 | 0.76 | LMNA (0.46) | HDAC1HDAC6HDAC2HDAC7HDAC8 | |
| SCHEMBL27795033 | 0.74 | MMP1 (0.49) | KMT2AMEN1HTTMAPT | |
| SCHEMBL13842150 | 0.73 | PTPN1 (0.47) | PTPN1PTPN11NPC1RAB9AALDH1A1 | |
| SCHEMBL9543659 | 0.73 | HDAC1 (0.50) | HDAC1HDAC6HDAC2HDAC7HDAC8 | |
| SCHEMBL8755361 | 0.73 | RAB9A (0.71) | HDAC1HDAC6HDAC2HDAC7HDAC8 | |
| SCHEMBL6028396 | 0.72 | ALDH1A1 (0.57) | HDAC1HDAC6HDAC2HDAC7HDAC8 | |
| SCHEMBL5716690 | 0.72 | KIF11 (0.45) | HDAC1HDAC6HDAC2HDAC7HDAC8 | |
| SCHEMBL28148996 | 0.71 | ALDH1A1 (0.45) | NPC1RAB9AKMT2ATP53HSD17B10 |
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-2003035615-A2 | TYROSINE KINASE INHIBITORS | MERCK & CO., INC. (US) | 2003-05-01 | — | — | WO | claimed |
| WO-2003035615-A2 | TYROSINE KINASE INHIBITORS | MERCK & CO., INC. (US) | 2003-05-01 | — | — | WO | disclosed |