Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 2/20 | 0.70 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.70 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.70 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.70 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.70 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.70 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.70 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.70 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.70 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.70 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.70 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.70 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.70 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.70 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.70 |
| ▸ | CA2 | P00918 | 11/20 | 0.65 |
| ▸ | CA1 | P00915 | 8/20 | 0.65 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.61 |
| ▸ | CA12 | O43570 | 5/20 | 0.56 |
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 | |
|---|---|---|---|---|
| Phenylbutanoic Acid SCHEMBL31228551 | 0.86 | HDAC1 (0.95) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| Phenylbutanoic Acid SCHEMBL28655271 | 0.84 | HDAC1 (0.84) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| Benzenesulfonamide SCHEMBL28116527 | 0.84 | CA1 (0.70) | CA2CA1CA12CA4TSHR | |
| Phenylbutanoic Acid SCHEMBL21219015 | 0.84 | HDAC1 (1.00) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| Phenylbutanoic Acid SCHEMBL1021513 | 0.84 | HDAC1 (1.00) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| Phenylbutanoic Acid SCHEMBL1716 | 0.84 | HDAC1 (1.00) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL22029354 | 0.83 | CA2 (0.75) | SMN1; SMN2CA2CA1MAPTRXFP1 | |
| Phenylbutanoic Acid SCHEMBL726614 | 0.82 | HDAC1 (0.95) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| Phenylbutanoic Acid SCHEMBL2010634 | 0.82 | HDAC1 (0.95) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| Phenylbutanoic Acid SCHEMBL29272534 | 0.82 | HDAC1 (0.95) | HDAC3HDAC4HDAC1HDAC7HDAC2 |
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-5792451-A | AMINO ACID DERIVATIVES AS CARRIERS FOR SENSITIVE AGENTS SUCH AS BIOACTIVE PEPTIDES | EMISPHERE TECHNOLOGIES, INC. (US) | 1998-08-11 | — | — | US | claimed |