Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.67 |
| ▸ | DHFR | P00374 | 1/20 | 0.67 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | PKM | P14618 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.49 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | MMP1 | P03956 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | MMP8 | P22894 | 1/20 | 0.46 |
| ▸ | MMP13 | P45452 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7541831 | 0.82 | SMN1; SMN2 (0.69) | SMN1; SMN2TDP1DHFRTSHRPKM | |
| SCHEMBL5931251 | 0.82 | SMN1; SMN2 (0.69) | SMN1; SMN2TDP1DHFRTSHRPKM | |
| SCHEMBL15321641 | 0.80 | SMN1; SMN2 (0.67) | SMN1; SMN2TDP1DHFRTSHRPKM | |
| SCHEMBL7402304 | 0.80 | TSHR (0.67) | SMN1; SMN2TDP1DHFRTSHRPKM | |
| SCHEMBL28687948 | 0.80 | SMN1; SMN2 (0.67) | SMN1; SMN2TDP1DHFRTSHRPKM | |
| SCHEMBL1684446 | 0.80 | DHFR (0.67) | SMN1; SMN2TDP1DHFRTSHRPKM | |
| Sulfacetamide SCHEMBL40863 | 0.80 | SMN1; SMN2 (1.00) | SMN1; SMN2TDP1DHFRTSHRPKM | |
| SCHEMBL7714429 | 0.80 | POLB (0.81) | SMN1; SMN2TDP1DHFRTSHRPKM | |
| SCHEMBL8777213 | 0.80 | SMN1; SMN2 (0.67) | SMN1; SMN2TDP1DHFRTSHRPKM | |
| SCHEMBL29238320 | 0.80 | SMN1; SMN2 (0.67) | SMN1; SMN2TDP1DHFRTSHRPKM |
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-2014200885-A1 | PDE10a INHIBITORS FOR THE TREATMENT OF TYPE II DIABETES | JANSSEN PHARMACEUTICA NV (BE) | 2014-12-18 | — | — | WO | disclosed |