Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 3/20 | 0.52 |
| ▸ | CHUK | O15111 | 1/20 | 0.48 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.48 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 5/20 | 0.41 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | STAT3 | P40763 | 2/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7153588 | 0.89 | CASP3 (0.53) | CASP3CHUKTXNRD1NOX4NPC1 | |
| SCHEMBL6448883 | 0.84 | CASP3 (0.48) | CASP3CHUKTXNRD1NOX4GRM5 | |
| SCHEMBL7051693 | 0.84 | CHUK (0.68) | CASP3CHUKTXNRD1NOX4NPC1 | |
| SCHEMBL7158427 | 0.78 | CASP3 (0.49) | CASP3CHUKTXNRD1NOX4NPC1 | |
| SCHEMBL6451251 | 0.78 | NPC1 (0.40) | CASP3NPC1RAB9ANPSR1 | |
| SCHEMBL6454607 | 0.78 | GRM5 (0.62) | NPC1RAB9AGRM5NPSR1 | |
| SCHEMBL7157911 | 0.77 | CASP3 (0.44) | CASP3CHUKTXNRD1NOX4NPC1 | |
| SCHEMBL7044304 | 0.77 | CASP3 (0.50) | CASP3CHUKTXNRD1NOX4NPC1 | |
| SCHEMBL7188135 | 0.75 | CASP3 (0.42) | CASP3CHUKTXNRD1NOX4NPC1 | |
| SCHEMBL6457424 | 0.73 | CASP3 (0.48) | CASP3CHUKTXNRD1NOX4NPC1 |
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-2004110351-A2 | HETEROCYCLIC COMPOUNDS FOR TREATING HEPATITIS C VIRUS | ANADYS PHARMACEUTICALS, INC. (US) | 2004-12-23 | — | — | WO | disclosed |