Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | PDE5A | O76074 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | PDE1A | P54750 | 1/20 | 0.46 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.46 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | EGFR | P00533 | 2/20 | 0.44 |
| ▸ | DHFR | P00374 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.44 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL465800 | 0.83 | SMN1; SMN2 (0.56) | POLBSMN1; SMN2KMT2AEGFRDHFR | |
| SCHEMBL3235100 | 0.81 | HDAC3 (0.62) | SMN1; SMN2HDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL7934041 | 0.78 | POLB (0.60) | POLBPDE5APDE1APDE1BPDE1C | |
| SCHEMBL465864 | 0.74 | SIRT1 (0.54) | POLBSMN1; SMN2KMT2AEGFRDHFR | |
| SCHEMBL6183627 | 0.72 | GAA (0.52) | SMN1; SMN2KMT2ALMNAMEN1MAPT | |
| SCHEMBL998227 | 0.72 | SMN1; SMN2 (0.45) | POLBSMN1; SMN2KMT2AEGFRDHFR | |
| SCHEMBL12631198 | 0.72 | SMN1; SMN2 (0.60) | SMN1; SMN2HTTMAPT | |
| SCHEMBL7924468 | 0.72 | POLB (0.58) | POLBPDE5ASMN1; SMN2LMNAMAPK1 | |
| SCHEMBL741687 | 0.71 | SMN1; SMN2 (0.58) | SMN1; SMN2HTTMAPT | |
| SCHEMBL3262614 | 0.70 | HDAC3 (0.50) | HDAC3HDAC1HDAC2HDAC10HDAC6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010028193-A1 | COMPOUNDS INCLUDING PIMELIC ACID DERIVATIVES AS HDAC INHIBITORS | REPLIGEN CORPORATION (US) | 2010-03-11 | — | — | WO | disclosed |