Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL24248047 | 0.90 | FFAR1 (0.53) | HRH3CYP1A2CYP2D6P4HTMSMN1; SMN2 | |
| SCHEMBL11656517 | 0.88 | HDAC3 (0.53) | CYP1A2HSD17B10P4HTMSMN1; SMN2MAPK1 | |
| SCHEMBL5411443 | 0.85 | HRH3 (0.43) | HRH3CYP1A2CYP2D6P4HTMSMN1; SMN2 | |
| SCHEMBL2563630 | 0.83 | P4HTM (0.56) | CYP1A2HSD17B10P4HTMSMN1; SMN2MAPK1 | |
| SCHEMBL7206139 | 0.80 | SMN1; SMN2 (0.47) | CYP1A2HSD17B10SMN1; SMN2MAPK1HDAC3 | |
| SCHEMBL22652852 | 0.80 | P4HTM (0.60) | CYP1A2P4HTMSMN1; SMN2FFAR1KDM4E | |
| SCHEMBL2439132 | 0.80 | NPC1 (0.49) | HRH3CYP1A2CYP2D6HSD17B10P4HTM | |
| SCHEMBL458571 | 0.79 | ALDH1A1 (0.60) | CYP1A2HSD17B10P4HTMSMN1; SMN2MAPK1 | |
| SCHEMBL2619348 | 0.79 | HRH3 (0.56) | HRH3CYP1A2CYP2D6SMN1; SMN2MAPK1 | |
| SCHEMBL26803754 | 0.79 | HRH3 (0.49) | HRH3CYP1A2CYP2D6SMN1; SMN2MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0882712-B1 | PROCESS FOR PREPARING ACID SALTS OF GAMMA-(PIPERIDYL)BUTYRIC ACID | KOEI CHEMICAL CO (JP) | 2003-04-23 | — | — | EP | disclosed |
| US-6197961-B1 | HYDROGENATION OF G-(PYRIDYL)BUTYRIC ACID SALT IN SOLVENT USING PALLADIUM, RHODIUM, OR RUTHENIUM CATALYST; HYDROLYSIS, DECARBOXYLATION | KOEI CHEMICAL CO., LTD. (JP) | 2001-03-06 | — | — | US | disclosed |
| EP-0882712-A1 | PROCESS FOR PREPARING ACID SALTS OF $g(g)-(PIPERIDYL)BUTYRIC ACID | KOEI CHEMICAL CO., LTD. (JP) | 1998-12-09 | — | — | EP | disclosed |