Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 7/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.31 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9920622 | 0.77 | PDE10A (0.38) | CYP1A2CYP2C19RAB9AADORA2AADORA1 | |
| SCHEMBL17429941 | 0.72 | CYP2A6 (0.37) | — | |
| SCHEMBL21405932 | 0.72 | CA2 (0.39) | CA2CYP1A2CYP2C19RAB9AHSD17B10 | |
| SCHEMBL29163818 | 0.72 | ALDH1A1 (0.45) | CYP1A2RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL27586712 | 0.71 | ALDH1A1 (0.36) | CA2RAB9AHSD17B10ADORA2AKDM4E | |
| SCHEMBL4266167 | 0.70 | MAPT (0.49) | CYP1A2CYP2C19RAB9AMAPTKDM4E | |
| SCHEMBL7534470 | 0.70 | ALDH1A1 (0.44) | CYP1A2CYP2C19RAB9AMAPTKDM4E | |
| SCHEMBL10682692 | 0.70 | CSNK2A2 (0.37) | RAB9AHSD17B10MAPTKDM4EGAA | |
| SCHEMBL27502600 | 0.69 | KDM4E (0.39) | CA2CYP2C19HSD17B10ADORA2AADORA1 | |
| SCHEMBL286929 | 0.68 | MGAM (0.48) | HSD17B10KDM4EALDH1A1HPGDLMNA |
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-1781289-A1 | THIENOPYRIDINES FOR TREATING HEPATITIS C | PTC Therapeutics, Inc. (US) | 2007-05-09 | — | — | EP | disclosed |
| WO-2006019832-A1 | THIENOPYRIDINES FOR TREATING HEPATITIS C | PTC THERAPEUTICS, INC. (US) | 2006-02-23 | — | — | WO | disclosed |