Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.38 |
| ▸ | TNF | P01375 | 2/20 | 0.38 |
| ▸ | NOD2 | Q9HC29 | 2/20 | 0.38 |
| ▸ | NOD1 | Q9Y239 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
| ▸ | MLNR | O43193 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | PDE9A | O76083 | 1/20 | 0.37 |
| ▸ | CHKA | P35790 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17078927 | 1.00 | MAPK1 (0.42) | MAPK1SMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL20421235 | 0.90 | PDE9A (0.40) | SMN1; SMN2MEN1KMT2AMLNRCYP3A4 | |
| SCHEMBL17078554 | 0.90 | HDAC1 (0.49) | SMN1; SMN2MEN1KMT2ATNFNOD2 | |
| SCHEMBL17078654 | 0.86 | SIRT1 (0.38) | MAPK1SMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL17078673 | 0.85 | MAPK1 (0.43) | MAPK1SMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL17078550 | 0.83 | POLB (0.40) | MEN1KMT2AALDH1A1MLNRCYP3A4 | |
| SCHEMBL17078656 | 0.83 | PIK3CD (0.42) | MAPK1SMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL17078650 | 0.83 | MAPK1 (0.41) | MAPK1SMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL17078756 | 0.81 | MAPK1 (0.47) | MAPK1SMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL17078836 | 0.80 | KMT2A (0.41) | MAPK1SMN1; SMN2MEN1KMT2AALDH1A1 |
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-3116859-A1 | NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | Chong Kun Dang Pharmaceutical Corp. (KR) | 2017-01-18 | — | — | EP | disclosed |
| WO-2015137750-A1 | NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP. (KR) | 2015-09-17 | — | — | WO | disclosed |