Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19976950 | 0.85 | ALDH1A1 (0.51) | HDAC1HDAC8HDAC6SMN1; SMN2ALDH1A1 | |
| SCHEMBL19976953 | 0.85 | LMNA (0.56) | HDAC1HDAC8HDAC6SMN1; SMN2ALDH1A1 | |
| SCHEMBL19976922 | 0.84 | HPGD (0.66) | SMN1; SMN2ALDH1A1LMNAHTTPOLB | |
| SCHEMBL16999773 | 0.82 | CTSL (0.54) | L3MBTL1 | |
| SCHEMBL16993903 | 0.79 | CTSL (0.57) | HDAC1HDAC8HDAC6 | |
| SCHEMBL19976955 | 0.77 | POLB (0.53) | SMN1; SMN2ALDH1A1LMNAHTTPOLB | |
| SCHEMBL5660269 | 0.77 | GPR35 (0.53) | SMN1; SMN2ALDH1A1LMNAL3MBTL1HPGD | |
| SCHEMBL31436845 | 0.76 | ALDH1A1 (0.74) | SMN1; SMN2ALDH1A1LMNAL3MBTL1MAPT | |
| SCHEMBL10072633 | 0.76 | ALDH1A1 (0.74) | SMN1; SMN2ALDH1A1LMNAL3MBTL1MAPT | |
| SCHEMBL19976974 | 0.75 | MEN1 (0.58) | HDAC8HDAC6SMN1; SMN2ALDH1A1LMNA |
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-9919998-B2 | Antibacterial agents: Nα-aroyl-N-aryl-phenylalaninamides | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2018-03-20 | — | — | US | disclosed |