Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 2/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7990882 | 0.88 | HTT (0.46) | HTTHDAC3HDAC1HDAC2POLB | |
| SCHEMBL7973249 | 0.83 | ALDH1A1 (0.47) | KMT2AMAPTTDP1ALDH1A1CA2 | |
| SCHEMBL7973489 | 0.83 | KDM4E (0.41) | HTTHDAC3HDAC1HDAC2POLB | |
| SCHEMBL7987813 | 0.83 | HTR7 (0.45) | HDAC3HDAC1HDAC2POLBKMT2A | |
| SCHEMBL7973495 | 0.83 | NPSR1 (0.46) | CES2CES1HSD11B1ALDH1A1 | |
| SCHEMBL7989108 | 0.83 | L3MBTL1 (0.48) | POLBKMT2AMAPTMEN1ALDH1A1 | |
| SCHEMBL7983580 | 0.81 | HDAC1 (0.43) | HTTHDAC3HDAC1HDAC2POLB | |
| SCHEMBL7983696 | 0.81 | CES2 (0.46) | HTTHDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL7987821 | 0.81 | USP5 (0.41) | HTTPOLBKMT2AMAPTMEN1 | |
| SCHEMBL7984806 | 0.80 | PARP10 (0.50) | HTTKMT2AALDH1A1CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6331628-B1 | REACTING A SUBSTITUTED HALOBENZENE WITH POTASSIUM, SODIUM AND/OR ZINC CYANIDE IN THE PRESENCE OF A METALLIC CATALYST | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2001-12-18 | — | — | US | disclosed |