Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 7/20 | 0.62 |
| ▸ | NCOR2 | Q9Y618 | 3/20 | 0.62 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.51 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.51 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.51 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.51 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3233893 | 1.00 | HDAC3 (0.62) | HDAC3NCOR2HDAC1HDAC2HDAC8 | |
| SCHEMBL3238191 | 1.00 | HDAC3 (0.62) | HDAC3NCOR2HDAC1HDAC2HDAC8 | |
| SCHEMBL3227971 | 0.99 | HDAC3 (0.60) | HDAC3NCOR2HDAC1HDAC2HDAC8 | |
| SCHEMBL3265600 | 0.94 | HDAC3 (0.58) | HDAC3NCOR2HDAC1HDAC2HDAC8 | |
| SCHEMBL6763786 | 0.89 | HDAC3 (0.74) | HDAC3NCOR2HDAC1HDAC2HDAC8 | |
| SCHEMBL9191952 | 0.88 | HDAC3 (0.71) | HDAC3NCOR2HDAC1HDAC2HDAC8 | |
| SCHEMBL13087750 | 0.86 | HDAC3 (0.62) | HDAC3NCOR2HDAC1HDAC2HDAC8 | |
| SCHEMBL3058857 | 0.86 | HDAC3 (0.62) | HDAC3NCOR2HDAC1HDAC2HDAC8 | |
| SCHEMBL13087529 | 0.86 | HDAC3 (0.62) | HDAC3NCOR2HDAC1HDAC2HDAC8 | |
| SCHEMBL1374654 | 0.85 | HDAC3 (0.68) | HDAC3NCOR2HDAC1HDAC2HDAC8 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2190845-A2 | HDAC INHIBITORS | ArQule, Inc. (US) | 2010-06-02 | — | — | EP | disclosed |
| WO-2009026446-A9 | HDAC INHIBITORS | ARQULE, INC. (US) | 2010-03-11 | — | — | WO | disclosed |
| WO-2009026446-A2 | HDAC INHIBITORS | ARQULE, INC. (US) | 2009-02-26 | — | — | WO | disclosed |