Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | TNKS | O95271 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | TACR1 | P25103 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9871811 | 1.00 | HCAR2 (0.43) | HCAR2HDAC3TNKSHDAC4HDAC1 | |
| SCHEMBL9871013 | 0.85 | KMT2A (0.43) | HDAC3HDAC1HDAC8TACR1ALDH1A1 | |
| SCHEMBL9871017 | 0.85 | KMT2A (0.43) | HDAC3HDAC1HDAC8TACR1ALDH1A1 | |
| SCHEMBL9871401 | 0.80 | MEN1 (0.44) | TACR1ALDH1A1GAASMN1; SMN2POLB | |
| SCHEMBL9871387 | 0.80 | MEN1 (0.44) | TACR1ALDH1A1GAASMN1; SMN2POLB | |
| SCHEMBL9871200 | 0.80 | CHEK1 (0.42) | TACR1ALDH1A1MEN1KMT2AMKNK1 | |
| SCHEMBL9870737 | 0.79 | CHEK1 (0.40) | TACR1ALDH1A1SMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL9870731 | 0.79 | CHEK1 (0.40) | TACR1ALDH1A1SMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL9871009 | 0.78 | AKR1C3 (0.46) | TACR1RXRARXRBNR4A2MKNK1 | |
| SCHEMBL9871020 | 0.78 | AKR1C3 (0.46) | TACR1RXRARXRBNR4A2MKNK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4997837-A | Enzyme inhibitors | WARNER-LAMBERT COMPANY (US) | 1991-03-05 | — | — | US | disclosed |
| US-4906624-A | 6-(((Substituted)pyridin-3-yl)alkyl)-and alkenyl)-tetrahydro-4-hydroxypyran-2-one inhibitors of cholesterol biosynthesis | WARNER-LAMBERT COMPANY (US) | 1990-03-06 | — | — | US | disclosed |
| EP-0306929-A2 | 6-[[(Substituted)pyridin-3-YL]alkyl]-and alkenyl]-tetrahydro-4-hydroxypyran-2-one inhibitors of cholesterol biosynthesis | WARNER-LAMBERT COMPANY (US) | 1989-03-15 | — | — | EP | disclosed |