Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7360954 | 0.85 | DRD2 (0.40) | CYP3A4CYP2C19HIF1AUSP2ALDH1A1 | |
| SCHEMBL27627652 | 0.83 | CYP2C19 (0.38) | CYP3A4CYP2C19HIF1AUSP2ALDH1A1 | |
| SCHEMBL27508208 | 0.80 | FFAR1 (0.38) | CYP3A4CYP2C19HIF1AUSP2ALDH1A1 | |
| SCHEMBL16760058 | 0.78 | AKR1C3 (0.43) | ALDH1A1MEN1KMT2ATSHRSMN1; SMN2 | |
| SCHEMBL15059997 | 0.78 | FFAR1 (0.44) | CYP3A4CYP2C19HIF1AUSP2ALDH1A1 | |
| SCHEMBL11250730 | 0.76 | METAP2 (0.41) | FFAR1MEN1KMT2ATSHRSMN1; SMN2 | |
| SCHEMBL2899064 | 0.76 | CYP3A4 (0.40) | CYP3A4CYP2C19HIF1AUSP2ALDH1A1 | |
| SCHEMBL3836402 | 0.75 | CYP3A4 (0.39) | CYP3A4CYP2C19HIF1AUSP2ALDH1A1 | |
| SCHEMBL2733709 | 0.73 | NR1H2 (0.52) | CYP3A4CYP2C19HIF1AALDH1A1FFAR1 | |
| SCHEMBL2733711 | 0.73 | NR1H2 (0.52) | CYP3A4CYP2C19HIF1AALDH1A1FFAR1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109651342-A | The inhibitor of hepatitis c viral replication | 默沙东公司 | 2019-04-19 | — | — | CN | disclosed |
| CN-103880862-B | The inhibitor of hepatitis c viral replication | 默沙东公司 | 2018-09-25 | — | — | CN | disclosed |
| CN-102427729-A | Inhibitors of hepatitis c virus replication | MERCK SHARP & DOHME | 2012-04-25 | — | — | CN | disclosed |
| EP-2410844-A1 | INHIBITORS OF HEPATITIS C VIRUS REPLICATION | Merck Sharp & Dohme Corp. (US) | 2012-02-01 | — | — | EP | disclosed |
| WO-2010111483-A1 | INHIBITORS OF HEPATITIS C VIRUS REPLICATION | MERCK SHARP & DOHME CORP. (US) | 2010-09-30 | — | — | WO | disclosed |