Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.54 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.53 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.52 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL443561 | 0.82 | HDAC1 (0.62) | KMT2AALDH1A1HDAC1HDAC2RXFP1 | |
| SCHEMBL4248226 | 0.79 | HDAC1 (0.59) | KMT2AALDH1A1HDAC1HDAC2RXFP1 | |
| SCHEMBL4438351 | 0.79 | HPGD (0.48) | KMT2AALDH1A1POLBSMN1; SMN2HPGD | |
| SCHEMBL4438509 | 0.79 | HPGD (0.53) | KMT2AALDH1A1HDAC1HDAC2POLB | |
| SCHEMBL4428958 | 0.78 | SMN1; SMN2 (0.52) | KMT2AALDH1A1HDAC1HDAC2POLB | |
| SCHEMBL3665639 | 0.78 | HDAC2 (0.52) | ALDH1A1HDAC1HDAC2RXFP1ADORA2A | |
| SCHEMBL4426592 | 0.77 | POLB (0.56) | KMT2AHDAC1HDAC2NPC1RAB9A | |
| SCHEMBL4033454 | 0.76 | HPGD (0.49) | KMT2AALDH1A1HDAC1HDAC2RAB9A | |
| SCHEMBL3664341 | 0.75 | HDAC1 (0.54) | ALDH1A1HDAC1HDAC2RXFP1ADORA2A | |
| SCHEMBL5584871 | 0.74 | KMT2A (0.72) | KMT2AALDH1A1HDAC1HDAC2RXFP1 |
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-2099442-A1 | METHOD OF USING HISTONE DEACETYLASE INHIBITORS AND MONITORING BIOMARKERS IN COMBINATION THERAPY | PHARMACYCLICS, INC. (US) | 2009-09-16 | — | — | EP | disclosed |
| WO-2008082856-A1 | METHOD OF USING HISTONE DEACETYLASE INHIBITORS AND MONITORING BIOMARKERS IN COMBINATION THERAPY | PHARMACYCLICS, INC. (US) | 2008-07-10 | — | — | WO | disclosed |