Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 6/20 | 0.32 |
| ▸ | NR5A2 | O00482 | 1/20 | 0.32 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | RXRA | P19793 | 2/20 | 0.30 |
| ▸ | RARG | P13631 | 1/20 | 0.30 |
| ▸ | PPARG | P37231 | 1/20 | 0.30 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27648661 | 0.68 | BRPF1 (0.39) | NPC1RAB9A | |
| SCHEMBL28100587 | 0.68 | XDH (0.38) | RAB9A | |
| SCHEMBL27405878 | 0.67 | KDM4E (0.53) | SMN1; SMN2 | |
| SCHEMBL21024069 | 0.66 | CREBBP (0.41) | CFTR | |
| SCHEMBL12291953 | 0.65 | KIF11 (0.37) | HSP90AA1SMN1; SMN2 | |
| SCHEMBL27532481 | 0.64 | MEN1 (0.51) | — | |
| SCHEMBL28303468 | 0.64 | TDP1 (0.31) | SMN1; SMN2RXRA | |
| SCHEMBL29188793 | 0.63 | TDP1 (0.51) | SMN1; SMN2RXRARARG | |
| SCHEMBL27545498 | 0.63 | NR4A2 (0.40) | RAB9A | |
| SCHEMBL27660772 | 0.62 | CSNK2A2 (0.61) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101268062-A | 2-hydroxy-propionic acid derivatives and 3-hydroxy-benzofuran-2-one derivatives with affinity for the GABA-B-receptor | HOFFMANN LA ROCHE (CH) | 2008-09-17 | — | — | CN | disclosed |