Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 1/20 | 0.63 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.63 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.63 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.61 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Hydrocinnamoylglycine SCHEMBL3995983 | 1.00 | HDAC2 (0.63) | HDAC2HDAC8HDAC6KEAP1HDAC1 | |
| SCHEMBL4657034 | 0.92 | HDAC1 (0.66) | HDAC2HDAC8HDAC6HDAC1MAPT | |
| SCHEMBL402513 | 0.89 | HDAC1 (0.66) | HDAC2HDAC8HDAC6HDAC1HPGD | |
| SCHEMBL7450998 | 0.89 | HDAC2 (0.63) | HDAC2HDAC8HDAC6KEAP1HDAC1 | |
| SCHEMBL9369915 | 0.87 | LMNA (0.67) | HDAC2HDAC8HDAC6HDAC1MAPT | |
| SCHEMBL7455811 | 0.86 | HDAC2 (0.66) | HDAC2HDAC8HDAC6KEAP1HDAC1 | |
| SCHEMBL7607135 | 0.86 | HDAC1 (0.68) | HDAC2HDAC8HDAC6HDAC1MAPT | |
| SCHEMBL7769503 | 0.85 | HDAC2 (0.59) | HDAC2HDAC8HDAC6HDAC1MAPT | |
| SCHEMBL1221588 | 0.85 | HDAC2 (0.57) | HDAC2HDAC8HDAC6HDAC1ALDH1A1 | |
| SCHEMBL16588648 | 0.85 | ALDH1A1 (0.63) | HDAC2HDAC8HDAC6HDAC1MAPT |
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-20220050090-A1 | MASS SPECTROMETRY ASSAY METHOD FOR DETECTION AND QUANTITATION OF MICROBIOTA RELATED METABOLITES | METABOLON, INC. | 2022-02-17 | — | — | US | disclosed |