Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABBR2 | O75899 | 2/20 | 0.55 |
| ▸ | GABBR1 | Q9UBS5 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5321126 | 0.94 | GABBR2 (0.53) | GABBR2GABBR1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL5320904 | 0.91 | GABBR2 (0.58) | GABBR2GABBR1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL9467365 | 0.91 | ALDH1A1 (0.54) | ALDH1A1TSHRTDP1L3MBTL1SMN1; SMN2 | |
| SCHEMBL9468152 | 0.87 | ALDH1A1 (0.50) | GABBR2GABBR1ALDH1A1TSHRTDP1 | |
| SCHEMBL9467430 | 0.86 | ALDH1A1 (0.59) | ALDH1A1TSHRTDP1L3MBTL1SMN1; SMN2 | |
| SCHEMBL14680082 | 0.85 | NPC1 (0.56) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL5319563 | 0.85 | GABBR2 (0.62) | GABBR2GABBR1ALDH1A1TSHRSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL987303 | 0.84 | GABBR2 (0.60) | GABBR2GABBR1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL23191566 | 0.83 | TSHR (0.53) | ALDH1A1TSHRTDP1L3MBTL1SMN1; SMN2 | |
| SCHEMBL5720836 | 0.82 | TSHR (0.49) | ALDH1A1TSHRTDP1L3MBTL1SMN1; SMN2 |
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 |