Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 6/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.41 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.41 |
| ▸ | ITGAV | P06756 | 1/20 | 0.39 |
| ▸ | NMT1 | P30419 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CCR2 | P41597 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20899659 | 0.85 | HSD11B1 (0.40) | ACLYHSD11B1SLC40A1ITGAVNMT1 | |
| SCHEMBL6611738 | 0.82 | ITGAV (0.39) | ACLYHSD11B1SLC40A1ITGAVNMT1 | |
| SCHEMBL6616050 | 0.82 | HSD11B1 (0.40) | ACLYHSD11B1SLC40A1ITGAVNMT1 | |
| SCHEMBL6610943 | 0.81 | HSD11B1 (0.38) | ACLYHSD11B1SLC40A1ITGAVNMT1 | |
| SCHEMBL6610827 | 0.80 | HSD11B1 (0.52) | ACLYHSD11B1SLC40A1GAAALDH1A1 | |
| SCHEMBL6610889 | 0.79 | HSD11B1 (0.52) | ACLYHSD11B1SLC40A1ITGAVALDH1A1 | |
| SCHEMBL6616741 | 0.79 | HSD11B1 (0.66) | ACLYHSD11B1GAAPOLBALDH1A1 | |
| SCHEMBL6612070 | 0.76 | HSD11B1 (0.40) | HSD11B1SLC40A1ITGAVPOLBMEN1 | |
| SCHEMBL6616669 | 0.76 | PFKFB3 (0.36) | HSD11B1SLC40A1ITGAVGAAPKM | |
| SCHEMBL6614777 | 0.76 | PFKFB3 (0.35) | HSD11B1SLC40A1ITGAVGAAPOLB |
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-2019075394-A1 | COMPOUNDS FOR TREATMENT OF EMOTIONAL/PSYCHOLOGICAL SYMPTOMS IN FRAGILE X SYNDROME | VANDERKLISH PETER (US) | 2019-04-18 | — | — | WO | disclosed |