Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ASPH | Q12797 | 2/20 | 0.38 |
| ▸ | KDM8 | Q8N371 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 3/20 | 0.35 |
| ▸ | CES1 | P23141 | 3/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | JMJD6 | Q6NYC1 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.31 |
| ▸ | FEN1 | P39748 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31305800 | 0.80 | TSHR (0.37) | KDM4EKMT2ASMN1; SMN2 | |
| SCHEMBL25199284 | 0.78 | KDM4E (0.38) | KDM4EASPHKDM8CES2CES1 | |
| SCHEMBL1395991 | 0.72 | AGBL2 (0.41) | KDM4EASPHKDM8PTGS2MAOB | |
| SCHEMBL23847036 | 0.72 | PTGS2 (0.32) | PTGS2 | |
| SCHEMBL21599038 | 0.71 | RAB9A (0.35) | KDM4EASPHKDM8PTGS2SMN1; SMN2 | |
| SCHEMBL4187455 | 0.69 | SMN1; SMN2 (0.40) | KMT2ASMN1; SMN2POLB | |
| SCHEMBL29465147 | 0.69 | DGAT1 (0.35) | KDM4EASPHKDM8KMT2APOLB | |
| SCHEMBL17480173 | 0.69 | BACE1 (0.38) | MAOB | |
| SCHEMBL10081962 | 0.69 | DGAT1 (0.35) | KDM4EASPHKDM8KMT2APOLB | |
| SCHEMBL6179156 | 0.69 | CYP4F2 (0.34) | KDM4EASPHKDM8 |
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-117384086-A | Synthesis method of chiral 2, 2-trifluoro-1- (pyridin-2-yl) ethane-1-alcohol | 苏州凯瑞医药科技有限公司 | 2024-01-12 | — | — | CN | claimed |
| CN-117384086-A | Synthesis method of chiral 2, 2-trifluoro-1- (pyridin-2-yl) ethane-1-alcohol | 苏州凯瑞医药科技有限公司 | 2024-01-12 | — | — | CN | disclosed |