Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 6/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.42 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4179001 | 0.87 | KMT2A (0.63) | KMT2AHPGDEPHX1RAB9ANPC1 | |
| SCHEMBL4179368 | 0.87 | KMT2A (0.63) | KMT2AHPGDEPHX1RAB9ANPC1 | |
| SCHEMBL13043831 | 0.84 | KMT2A (0.59) | KMT2AHPGDEPHX1RAB9ANPC1 | |
| SCHEMBL6274645 | 0.74 | HPGD (0.53) | KMT2AHPGDEPHX1RAB9ANPC1 | |
| SCHEMBL11356392 | 0.74 | HPGD (0.53) | KMT2AHPGDEPHX1RAB9ANPC1 | |
| SCHEMBL24986 | 0.74 | EPHX1 (0.50) | KMT2AHPGDEPHX1EPHX2 | |
| SCHEMBL29291474 | 0.74 | EPHX1 (0.50) | KMT2AHPGDEPHX1EPHX2 | |
| SCHEMBL29291470 | 0.74 | EPHX1 (0.50) | KMT2AHPGDEPHX1EPHX2 | |
| SCHEMBL20379771 | 0.74 | EPHX1 (0.50) | KMT2AHPGDEPHX1EPHX2 | |
| SCHEMBL1327157 | 0.74 | EPHX1 (0.50) | KMT2AHPGDEPHX1EPHX2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1727516-A1 | COMPOSITION COMPRISING AN HDAC INHIBITOR IN COMBINATION WITH A RETINOID | DSM IP Assets B.V. (NL) | 2006-12-06 | — | — | EP | disclosed |
| WO-2005092283-A1 | COMPOSITION COMPRISING AN HDAC INHIBITOR IN COMBINATION WITH A RETINOID | DSM IP ASSETS B.V. (NL) | 2005-10-06 | — | — | WO | disclosed |