Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28985192 | 1.00 | HRH4 (0.40) | HRH4MAPTLNPEPHDAC3HDAC4 | |
| SCHEMBL28985178 | 0.81 | MAPT (0.39) | MAPTHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL28985172 | 0.81 | MAPT (0.39) | MAPTHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL28985162 | 0.76 | GRM4 (0.41) | MEN1NPC1RAB9AKMT2AALDH1A1 | |
| SCHEMBL28985163 | 0.76 | GRM4 (0.41) | MEN1NPC1RAB9AKMT2AALDH1A1 | |
| SCHEMBL10774082 | 0.76 | HRH4 (0.51) | HRH4MAPTLNPEPMEN1KMT2A | |
| SCHEMBL25697407 | 0.74 | HRH4 (0.54) | HRH4MAPTLNPEPHTTMEN1 | |
| SCHEMBL28985307 | 0.73 | RELA (0.44) | MAPTMEN1NPC1RAB9AKMT2A | |
| SCHEMBL28985184 | 0.73 | TRPA1 (0.44) | MAPTTP53MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL28985306 | 0.73 | SLC6A2 (0.44) | MAPTMEN1NPC1RAB9AKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-115974927-A | Diamine-derived phosphine chiral phosphine oxide ligand-promoted nickel-catalyzed asymmetric alkylation of pyridine C2-H bond | 南开大学 | 2023-04-18 | — | — | CN | disclosed |