Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GPR3 | P46089 | 1/20 | 0.40 |
| ▸ | KRAS | P01116 | 1/20 | 0.40 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12736488 | 0.78 | LMNA (0.61) | LMNAHTTTSHRALDH1A1CYP1A2 | |
| SCHEMBL12458584 | 0.77 | ALDH1A1 (0.57) | LMNAHTTTSHRALDH1A1GPR3 | |
| SCHEMBL11095223 | 0.76 | LMNA (0.43) | LMNAHTTTSHRALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL4644296 | 0.75 | ALDH1A1 (0.56) | LMNAHTTTSHRALDH1A1GPR3 | |
| SCHEMBL3974545 | 0.75 | NPY5R (0.66) | LMNAALDH1A1CYP1A2USP2CYP3A4 | |
| SCHEMBL16404470 | 0.71 | ABCG2 (0.61) | HTTMEN1KMT2AKDM4ENPY5R | |
| SCHEMBL3977315 | 0.71 | RAD52 (0.71) | LMNAHTTTSHRALDH1A1MEN1 | |
| SCHEMBL27393844 | 0.71 | CYP1A2 (0.65) | LMNATSHRALDH1A1CYP1A2USP2 | |
| SCHEMBL10971806 | 0.70 | MAPT (0.55) | LMNACYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL4859263 | 0.70 | MAPK1 (0.64) | LMNAHTTTSHRALDH1A1CYP2C19 |
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-2016146074-A1 | HISTONE DEACETYLASE INHIBITOR, AND PREPARATION METHOD AND USE THEREOF | 广东众生药业股份有限公司 | 2016-09-22 | — | — | WO | disclosed |