Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.43 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.43 |
| ▸ | IKBKB | O14920 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.40 |
| ▸ | ACLY | P53396 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3809786 | 0.92 | ACLY (0.47) | HSD17B1HSD17B2S1PR1ACLYLMNA | |
| SCHEMBL3807904 | 0.91 | HSD17B1 (0.48) | NPSR1KDM4EHSD17B1HSD17B2S1PR1 | |
| SCHEMBL3807315 | 0.86 | PTPRF (0.43) | HSD17B1HSD17B2S1PR1 | |
| SCHEMBL2157464 | 0.86 | NPSR1 (0.55) | NPSR1KDM4EHSD17B1HSD17B2IKBKB | |
| SCHEMBL3811263 | 0.86 | NPSR1 (0.52) | NPSR1KDM4EIKBKBLMNAMAPT | |
| SCHEMBL3807312 | 0.85 | NPSR1 (0.53) | NPSR1KDM4EIKBKBACLY | |
| SCHEMBL3816996 | 0.84 | MCL1 (0.41) | HSD17B1HSD17B2ACLYTP53MAPT | |
| SCHEMBL3811663 | 0.82 | NPSR1 (0.48) | NPSR1KDM4EIKBKB | |
| SCHEMBL3811718 | 0.82 | KCNH2 (0.51) | NPSR1KDM4EIKBKB | |
| SCHEMBL3816532 | 0.80 | NPSR1 (0.69) | NPSR1KDM4EIKBKBLMNATP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1401825-B1 | THIOPHENE DERIVATIVES AS ANTIVIRAL AGENTS FOR FLAVIVIRUS INFECTION | VIROCHEM PHARMA INC (CA) | 2009-08-05 | — | — | EP | claimed |