Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.58 |
| ▸ | RAB9A | P51151 | 4/20 | 0.58 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.56 |
| ▸ | NPY1R | P25929 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | NPY2R | P49146 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | MMP13 | P45452 | 2/20 | 0.53 |
| ▸ | SCD | O00767 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | STAT1 | P42224 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL211614 | 0.84 | HDAC1 (0.74) | NPC1RAB9AMCL1SMN1; SMN2LMNA | |
| SCHEMBL2187627 | 0.84 | NPC1 (0.80) | NPC1RAB9AMCL1SMN1; SMN2LMNA | |
| SCHEMBL4914634 | 0.80 | NPC1 (0.74) | NPC1RAB9AMCL1SMN1; SMN2LMNA | |
| SCHEMBL3753095 | 0.79 | DYRK1A (0.71) | NPC1RAB9AMCL1SMN1; SMN2LMNA | |
| SCHEMBL16562175 | 0.76 | NPC1 (0.79) | NPC1RAB9AMCL1SMN1; SMN2LMNA | |
| SCHEMBL7128296 | 0.75 | NPC1 (0.77) | NPC1RAB9AMCL1SMN1; SMN2LMNA | |
| SCHEMBL19174351 | 0.75 | HDAC2 (0.76) | NPC1RAB9ASMN1; SMN2HTTMAPT | |
| SCHEMBL2189310 | 0.75 | SCD (0.74) | NPC1RAB9AMCL1SMN1; SMN2LMNA | |
| SCHEMBL2191669 | 0.74 | NPC1 (1.00) | NPC1RAB9AMCL1SMN1; SMN2LMNA | |
| SCHEMBL16684914 | 0.74 | HDAC1 (0.73) | NPC1RAB9AMAPTALDH1A1KMT2A |
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-1735319-A1 | INHIBITORS OF HISTONE DEACETYLASE | Methylgene, Inc. (CA) | 2006-12-27 | — | — | EP | disclosed |
| WO-2005092899-A1 | INHIBITORS OF HISTONE DEACETYLASE | METHYLGENE INC. (CA) | 2005-10-06 | — | — | WO | disclosed |