Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABBR2 | O75899 | 5/20 | 0.58 |
| ▸ | GABBR1 | Q9UBS5 | 5/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | F2 | P00734 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 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 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5320001 | 0.91 | GABBR2 (0.55) | GABBR2GABBR1ALDH1A1LMNAF2 | |
| SCHEMBL5321126 | 0.89 | GABBR2 (0.53) | GABBR2GABBR1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL5319563 | 0.88 | GABBR2 (0.62) | GABBR2GABBR1ALDH1A1LMNAF2 | |
| SCHEMBL19266684 | 0.86 | F2 (0.50) | GABBR2GABBR1ALDH1A1LMNAF2 | |
| Hydrochloric Acid SCHEMBL987303 | 0.86 | GABBR2 (0.60) | GABBR2GABBR1ALDH1A1LMNAF2 | |
| SCHEMBL28840739 | 0.84 | ALDH1A1 (0.47) | ALDH1A1LMNAF2CYP1A2CYP2D6 | |
| SCHEMBL28759435 | 0.82 | LMNA (0.53) | ALDH1A1LMNASMN1; SMN2NPSR1MEN1 | |
| SCHEMBL1138690 | 0.81 | LMNA (0.49) | ALDH1A1LMNACYP1A2CYP2D6PKM | |
| SCHEMBL5720971 | 0.81 | LMNA (0.49) | ALDH1A1LMNACYP1A2CYP2D6PKM | |
| SCHEMBL27682265 | 0.81 | LMNA (0.49) | ALDH1A1LMNACYP1A2CYP2D6PKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007096314-A2 | ENZYMATIC RESOLUTION OF RACEMIC 3-ARYL-4-AMINOBUTYRIC ACID | VEINBERG GRIGORY (LV) | 2007-08-30 | — | — | WO | claimed |