Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.49 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28603643 | 0.83 | KDM4E (0.44) | KMT2ANR2E1HSD17B10KDM4ECYP1A2 | |
| SCHEMBL28614947 | 0.82 | HDAC1 (0.52) | NR2E1 | |
| SCHEMBL4763963 | 0.80 | NR2E1 (0.52) | KMT2ANR2E1SLC2A1HSD17B10KDM4E | |
| SCHEMBL24479988 | 0.79 | NPSR1 (0.47) | NR2E1HSD17B10KDM4EALDH1A1MAPK1 | |
| SCHEMBL30523189 | 0.79 | KDM4E (0.63) | KMT2ANR2E1HSD17B10KDM4ECYP1A2 | |
| SCHEMBL30523188 | 0.79 | KDM4E (0.63) | KMT2ANR2E1HSD17B10KDM4ECYP1A2 | |
| SCHEMBL4728062 | 0.79 | KDM4E (0.63) | KMT2ANR2E1HSD17B10KDM4ECYP1A2 | |
| SCHEMBL31078247 | 0.79 | KDM4E (0.64) | KMT2ANR2E1SLC2A1HSD17B10KDM4E | |
| SCHEMBL4727252 | 0.79 | KDM4E (0.64) | KMT2ANR2E1SLC2A1HSD17B10KDM4E | |
| SCHEMBL4903024 | 0.79 | NR2E1 (0.64) | NR2E1HSD17B10KDM4ECYP1A2CYP2D6 |
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-2008021745-A2 | HEPATITIS C VIRUS ENTRY INHIBITORS | ITHERX PHARMACEUTICALS, INC. (US) | 2008-02-21 | — | — | WO | disclosed |