Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | POLQ | O75417 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL194877 | 0.84 | LMNA (0.41) | LMNAGAANFKB1ESR1POLQ | |
| SCHEMBL20560739 | 0.81 | LMNA (0.42) | LMNAGAANFKB1ESR1POLQ | |
| SCHEMBL10672986 | 0.79 | POLB (0.44) | LMNAGAAPOLQPOLBSLC6A2 | |
| SCHEMBL4602848 | 0.79 | POLQ (0.45) | LMNAGAANFKB1ESR1POLQ | |
| SCHEMBL5331837 | 0.74 | LMNA (0.42) | LMNAGAANFKB1ESR1POLQ | |
| SCHEMBL9780024 | 0.72 | RAB9A (0.44) | LMNAGAANFKB1ESR1POLQ | |
| SCHEMBL236493 | 0.72 | POLQ (0.38) | LMNAGAAPOLQALDH1A1POLB | |
| SCHEMBL10592171 | 0.72 | KDM4E (0.41) | LMNAGAANFKB1ALDH1A1POLB | |
| SCHEMBL14053642 | 0.71 | LMNA (0.40) | LMNAGAANFKB1ESR1POLQ | |
| SCHEMBL28869726 | 0.71 | AOC3 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-113135856-A | 3-trifluoromethyl-5-cyanopyrazole compounds and preparation method thereof | 天津大学 | 2021-07-20 | — | — | CN | disclosed |