Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.44 |
| ▸ | PDK2 | Q15119 | 10/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | RAD52 | P43351 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14101179 | 0.80 | RAD52 (0.51) | TSHRSMN1; SMN2CHRM1PDK2ALDH1A1 | |
| SCHEMBL16997509 | 0.78 | MEN1 (0.37) | TSHRSMN1; SMN2ALDH1A1NPSR1RAD52 | |
| Bromide SCHEMBL6851490 | 0.75 | PGR (0.42) | PDK2NPSR1 | |
| SCHEMBL31389172 | 0.70 | RAD52 (0.51) | TSHRSMN1; SMN2ALDH1A1RAD52 | |
| SCHEMBL16940892 | 0.67 | KMT2A (0.43) | TSHRALDH1A1NPSR1 | |
| SCHEMBL20229558 | 0.66 | KDM4E (0.31) | — | |
| SCHEMBL15203037 | 0.65 | PDK2 (0.76) | PDK2 | |
| SCHEMBL12536165 | 0.64 | TSHR (0.47) | TSHRSMN1; SMN2CHRM1PDK2ALDH1A1 | |
| SCHEMBL19319616 | 0.63 | CNR1 (0.40) | SMN1; SMN2CHRM1ALDH1A1NPSR1CNR1 | |
| SCHEMBL19654624 | 0.63 | MEN1 (0.37) | SMN1; SMN2PDK2CNR1GPR55TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2009502856-A | — | — | 2009-01-29 | — | — | JP | claimed |
| EP-1915357-A1 | 2-HYDROXY-PROPIONIC ACID DERIVATIVES AND 3-HYDROXY-BENZOFURAN-2-ONE DERIVATIVES WITH AFFINITY FOR THE GABA-B-RECEPTOR | F. Hoffmann-Roche AG (CH) | 2008-04-30 | — | — | EP | claimed |
| WO-2007014843-A1 | 2-HYDROXY-PROPIONIC ACID DERIVATIVES AND 3-HYDROXY-BENZOFURAN-2-ONE DERIVATIVES WITH AFFINITY FOR THE GABA-B-RECEPTOR | F. HOFFMANN-LA ROCHE AG (CH) | 2007-02-08 | — | — | WO | claimed |