Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABBR2 | O75899 | 5/20 | 0.54 |
| ▸ | GABBR1 | Q9UBS5 | 5/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MIF | P14174 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL656968 | 0.78 | GABBR2 (0.41) | GABBR2GABBR1CYP2C9CYP2C19MEN1 | |
| SCHEMBL11040097 | 0.75 | GABBR2 (0.57) | GABBR2GABBR1CYP2C9LMNACYP2C19 | |
| SCHEMBL9315749 | 0.73 | ALDH1A1 (0.36) | CYP2C19CYP1A2BLMMEN1KMT2A | |
| Phenibut SCHEMBL340838 | 0.71 | GABBR2 (1.00) | GABBR2GABBR1CYP2C9LMNACYP2C19 | |
| Phenibut SCHEMBL351501 | 0.71 | GABBR2 (1.00) | GABBR2GABBR1CYP2C9LMNACYP2C19 | |
| Phenibut SCHEMBL9545047 | 0.71 | GABBR2 (1.00) | GABBR2GABBR1CYP2C9LMNACYP2C19 | |
| SCHEMBL2966895 | 0.71 | KMT2A (0.45) | CYP2C9CYP1A2MEN1TSHRKMT2A | |
| SCHEMBL354785 | 0.70 | TAAR1 (0.44) | — | |
| Phenibut SCHEMBL22831453 | 0.70 | GABBR2 (0.96) | GABBR2GABBR1CYP2C9LMNACYP2C19 | |
| Phenibut SCHEMBL3053795 | 0.70 | GABBR2 (0.96) | GABBR2GABBR1CYP2C9LMNACYP2C19 |
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-0463969-B1 | New compounds of 4-aminobutyric acid, process for their preparation and pharmaceutical preparations containing them | ADIR (FR) | 1995-02-08 | — | — | EP | claimed |
| US-5214063-A | 4-aminobutyric acid compounds, compositions and methods of use for treating disorders related to a dysfunction of GABAB receptors | ADIR ET COMPAGNIE (FR) | 1993-05-25 | — | — | US | disclosed |
| US-5162364-A | Treatment of spastic and senescence disorders | ADIR ET COMPAGNIE (FR) | 1992-11-10 | — | — | US | disclosed |