Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | KCNQ4 | P56696 | 3/20 | 0.36 |
| ▸ | KCNQ5 | Q9NR82 | 3/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.36 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6181078 | 0.89 | RXFP1 (0.38) | CNR2RXFP1KCNQ4KCNQ5CYP17A1 | |
| SCHEMBL6290067 | 0.75 | ELANE (0.40) | RXFP1CYP17A1ATRBRD9PPARG | |
| SCHEMBL28210980 | 0.75 | BRD9 (0.39) | RXFP1CYP17A1ATRBRD9PPARG | |
| SCHEMBL628821 | 0.75 | MEN1 (0.45) | CNR2RXFP1BRD9CA12CA1 | |
| SCHEMBL8329109 | 0.75 | HTT (0.40) | CYP2C9CYP2C19KDM4EMEN1ALDH1A1 | |
| SCHEMBL1767849 | 0.75 | KMT2A (0.52) | RXFP1MAPTCA12CA1CA7 | |
| SCHEMBL27852761 | 0.75 | MEN1 (0.56) | PPARGPPARAMAPTCA12CA1 | |
| SCHEMBL31619048 | 0.75 | KMT2A (0.52) | RXFP1MAPTCA12CA1CA7 | |
| SCHEMBL24731578 | 0.74 | CYP17A1 (0.40) | RXFP1KCNQ4KCNQ5CYP17A1ATR | |
| SCHEMBL19182183 | 0.74 | CA12 (0.45) | CYP17A1PPARGPPARAMAPTCA12 |
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-2205563-A2 | NOVEL HISTONE DEACETYLASE INHIBITORS | Orchid Research Laboratories Limited (IN) | 2010-07-14 | — | — | EP | disclosed |
| WO-2009047615-A2 | NOVEL HISTONE DEACETYLASE INHIBITORS | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2009-04-16 | — | — | WO | disclosed |