Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.34 |
| ▸ | NAMPT | P43490 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18007455 | 0.92 | NAMPT (0.35) | MMP2CTSKPIK3CDABCB1TSHR | |
| SCHEMBL18007448 | 0.89 | MEN1 (0.38) | CTSKPIK3CDABCB1TSHRRECQL | |
| SCHEMBL18007451 | 0.86 | PIK3CD (0.39) | MMP2CTSKPIK3CDABCB1TSHR | |
| SCHEMBL18007459 | 0.85 | MMP2 (0.34) | MMP2KMT2A | |
| SCHEMBL18009462 | 0.83 | HPGD (0.40) | MMP2CTSKPIK3CDTSHRRECQL | |
| SCHEMBL18009292 | 0.83 | PIK3CD (0.41) | MMP2CTSKPIK3CDABCB1TSHR | |
| SCHEMBL18009294 | 0.82 | MMP2 (0.46) | MMP2CTSKPIK3CDTSHRRECQL | |
| SCHEMBL18009461 | 0.81 | PIK3CD (0.40) | MMP2CTSKPIK3CDABCB1TSHR | |
| SCHEMBL18009299 | 0.81 | PIK3CD (0.30) | PIK3CD | |
| SCHEMBL18009283 | 0.80 | ALDH1A1 (0.40) | MMP2PIK3CDTSHRRECQLSMN1; 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-2016127186-A1 | FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE | NGUYEN MARK QUANG (US) | 2016-08-11 | — | — | WO | disclosed |