Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHBP | P24387 | 1/20 | 0.56 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.51 |
| ▸ | CFTR | P13569 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.44 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA7 | P43166 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29979726 | 0.90 | ALDH1A1 (0.63) | CRHBPCRHR2ALDH1A1HSD17B10CFTR | |
| SCHEMBL3507300 | 0.90 | ALDH1A1 (0.63) | CRHBPCRHR2ALDH1A1HSD17B10CFTR | |
| SCHEMBL137907 | 0.84 | NPC1 (0.62) | CRHBPCRHR2ALDH1A1HSD17B10NPC1 | |
| SCHEMBL399125 | 0.80 | NPC1 (0.56) | CRHBPCRHR2ALDH1A1HSD17B10CFTR | |
| SCHEMBL12792953 | 0.80 | HSD17B10 (0.45) | CRHBPCRHR2ALDH1A1HSD17B10CFTR | |
| SCHEMBL8764887 | 0.80 | MAPT (0.71) | ALDH1A1HSD17B10CFTRNPC1GAA | |
| SCHEMBL2929420 | 0.79 | NPC1 (0.51) | CRHBPCRHR2ALDH1A1HSD17B10CFTR | |
| SCHEMBL9456728 | 0.79 | CRHBP (0.56) | CRHBPCRHR2ALDH1A1NPC1GAA | |
| SCHEMBL22164112 | 0.78 | NPC1 (0.57) | CRHBPCRHR2ALDH1A1HSD17B10NPC1 | |
| SCHEMBL30790667 | 0.78 | MAPT (0.74) | ALDH1A1HSD17B10CFTRNPC1GAA |
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-2008060844-A1 | POLYMERIZATION INHIBITOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE | ALBEMARLE CORPORATION (US) | 2008-05-22 | — | — | WO | disclosed |