Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.48 |
| ▸ | CETP | P11597 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.46 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3928302 | 0.85 | ALDH1A1 (0.56) | ALDH1A1HSD17B10KDM4EADORA1HPGD | |
| SCHEMBL4602392 | 0.82 | HDAC1 (0.56) | ALDH1A1HSD17B10KDM4EHPGDHDAC1 | |
| SCHEMBL2270149 | 0.81 | ACLY (0.57) | ALDH1A1HSD17B10KDM4EADORA1HPGD | |
| SCHEMBL4104696 | 0.79 | KDM4E (0.54) | ALDH1A1HSD17B10KDM4EADORA1HPGD | |
| SCHEMBL1308249 | 0.77 | HSD17B10 (0.64) | ALDH1A1HSD17B10KDM4ETSHRSMN1; SMN2 | |
| SCHEMBL7814976 | 0.76 | ALDH1A1 (0.68) | ALDH1A1HSD17B10KDM4EHPGDHDAC1 | |
| SCHEMBL11732563 | 0.76 | ALDH1A1 (0.68) | ALDH1A1HSD17B10KDM4EHPGDHDAC1 | |
| SCHEMBL38659461 | 0.76 | ALDH1A1 (0.94) | ALDH1A1HSD17B10KDM4EADORA1HPGD | |
| SCHEMBL4603626 | 0.76 | KDM4E (0.72) | ALDH1A1HSD17B10KDM4EHPGDTSHR | |
| SCHEMBL4617520 | 0.75 | PRSS12 (0.56) | ALDH1A1KDM4EHDAC1HDAC2HDAC3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1940786-A1 | BIPHENYL DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C | Arrow Therapeutics Limited (GB) | 2008-07-09 | — | — | EP | disclosed |
| WO-2007031791-A1 | BIPHENYL DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C | ARROW THERAPEUTICS LIMITED (GB) | 2007-03-22 | — | — | WO | disclosed |