Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 2/20 | 0.55 |
| ▸ | NOS2 | P35228 | 2/20 | 0.55 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | DNM2 | P50570 | 6/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | IDH1 | O75874 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 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 | |
|---|---|---|---|---|
| SCHEMBL9313985 | 0.89 | TLR8 (0.65) | NOS3NOS2TLR8ESR1ESR2 | |
| SCHEMBL24672584 | 0.87 | TLR8 (0.58) | NOS3NOS2TLR8ESR1ESR2 | |
| SCHEMBL8543215 | 0.85 | DNM2 (0.57) | NOS3NOS2TLR8ESR1ESR2 | |
| SCHEMBL8345724 | 0.83 | NOS3 (0.59) | NOS3NOS2TLR8ALDH1A1TP53 | |
| SCHEMBL11446300 | 0.83 | NOS3 (0.46) | NOS3NOS2TLR8ALDH1A1TP53 | |
| SCHEMBL7797450 | 0.82 | NOS3 (0.53) | NOS3NOS2TLR8ALDH1A1TP53 | |
| SCHEMBL23482212 | 0.82 | GAA (0.56) | NOS3NOS2TLR8ALDH1A1TP53 | |
| SCHEMBL11448132 | 0.80 | NOS3 (0.47) | NOS3NOS2TLR8ALDH1A1TP53 | |
| SCHEMBL11187910 | 0.79 | DNM2 (0.55) | NOS3NOS2TLR8ALDH1A1TP53 | |
| SCHEMBL16608745 | 0.78 | DNM2 (0.61) | TLR8ESR1ESR2ALDH1A1TP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-7868204-B2 | Inhibitors of histone deacetylase | METHYLGENE INC. (CA) | 2011-01-11 | — | — | US | disclosed |
| US-7838520-B2 | Inhibitors of histone deacetylase | METHYLGENE, INC. (CA) | 2010-11-23 | — | — | US | disclosed |
| US-7595343-B2 | Inhibitors of histone deacetylase | METHYLGENE, INC. (CA) | 2009-09-29 | — | — | US | disclosed |