Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | CDK4 | P11802 | 1/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 3/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | MYC | P01106 | 1/20 | 0.36 |
| ▸ | WDR5 | P61964 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PLTP | P55058 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.36 |
| ▸ | MAPKAPK2 | P49137 | 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 | |
|---|---|---|---|---|
| SCHEMBL16996770 | 0.80 | PTGDR2 (0.48) | PTGDR2ALDH1A1HPGDPTGS1PTGS2 | |
| SCHEMBL5522720 | 0.78 | ALDH1A1 (0.41) | PTGDR2ALDH1A1HPGDPTGS2KMT2A | |
| SCHEMBL3826066 | 0.75 | ALDH1A1 (0.39) | PTGDR2ALDH1A1HPGDPTGS2KMT2A | |
| SCHEMBL9727832 | 0.70 | CYP2A6 (0.49) | ALDH1A1HPGD | |
| SCHEMBL14564368 | 0.70 | RORB (0.42) | ALDH1A1HPGDPTGS1PTGS2KMT2A | |
| SCHEMBL12362816 | 0.69 | ALOX5 (0.52) | CDK4ESR1ESR2APPALOX5 | |
| SCHEMBL2090659 | 0.69 | ALDH1A1 (0.61) | PTGDR2ALDH1A1HPGDPTGS1PTGS2 | |
| SCHEMBL3976477 | 0.69 | KMT2A (0.48) | ALDH1A1HPGDKMT2AMEN1ESR1 | |
| SCHEMBL11751406 | 0.68 | MAPT (0.41) | ALDH1A1HPGDPTGS1PTGS2KMT2A | |
| SCHEMBL9159542 | 0.67 | MEN1 (0.62) | ALDH1A1HPGDKMT2AMEN1ESR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105315319-B | Hepatitis C virus inhibitor and application thereof | 南京圣和药业股份有限公司 | 2020-11-20 | — | — | CN | disclosed |
| CN-105315319-A | Hepatitis C virus inhibitor and application thereof | NANJING SANHOME PHARMACEUTICAL CO LTD | 2016-02-10 | — | — | CN | disclosed |