Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | RECQL | P46063 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7984979 | 0.89 | HDAC1 (0.46) | HDAC1HDAC3HDAC2HDAC8HDAC6 | |
| SCHEMBL7973249 | 0.81 | ALDH1A1 (0.47) | ALDH1A1NPC1MAPTLMNASMN1; SMN2 | |
| SCHEMBL7973224 | 0.81 | HTT (0.42) | HDAC1HDAC3HDAC2HDAC8HDAC6 | |
| SCHEMBL7973489 | 0.81 | KDM4E (0.41) | HDAC1HDAC3HDAC2ALDH1A1MAPT | |
| SCHEMBL7987813 | 0.81 | HTR7 (0.45) | HDAC1HDAC3HDAC2ALDH1A1NPC1 | |
| SCHEMBL7973495 | 0.80 | NPSR1 (0.46) | ALDH1A1LMNAPKMSMN1; SMN2NPSR1 | |
| SCHEMBL7990828 | 0.80 | HDAC1 (0.50) | HDAC1HDAC3HDAC8HDAC6EPHX2 | |
| SCHEMBL7983696 | 0.78 | CES2 (0.46) | HDAC1HDAC3HDAC2HDAC8HDAC6 | |
| SCHEMBL7987821 | 0.78 | USP5 (0.41) | ALDH1A1NPC1RAB9AMAPTLMNA | |
| SCHEMBL7984806 | 0.77 | PARP10 (0.50) | ALDH1A1NPC1RAB9ALMNASMN1; SMN2 |
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 |