Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.42 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.39 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.37 |
| ▸ | PDE2A | O00408 | 2/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.37 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.37 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14242807 | 0.93 | ESR2 (0.42) | HDAC4ESR2PDGFRBPDGFRAKDM4E | |
| SCHEMBL14243188 | 0.86 | ESR2 (0.40) | HDAC4ESR2PDGFRBPDGFRAKDM4E | |
| SCHEMBL30134165 | 0.79 | NT5E (0.54) | HDAC4KDM4EMAPTNT5EHTT | |
| SCHEMBL20364207 | 0.79 | NQO2 (0.46) | HDAC4KDM4EALDH1A1CDK2MAPT | |
| SCHEMBL31184015 | 0.79 | NQO2 (0.46) | HDAC4KDM4EALDH1A1CDK2MAPT | |
| SCHEMBL30702146 | 0.79 | HDAC4 (0.46) | HDAC4KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL20364201 | 0.79 | NT5E (0.54) | HDAC4KDM4EMAPTNT5EHTT | |
| SCHEMBL20364203 | 0.79 | HDAC4 (0.46) | HDAC4KDM4EALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL28218349 | 0.77 | HDAC4 (0.45) | HDAC4KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL30134226 | 0.76 | HDAC4 (0.42) | HDAC4KDM4E |
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-2012170371-A1 | COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS | N30 PHARMACEUTICALS, LLC (US) | 2012-12-13 | — | — | WO | disclosed |