Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | TNF | P01375 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 2/20 | 0.44 |
| ▸ | MMP9 | P14780 | 2/20 | 0.44 |
| ▸ | MITF | O75030 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL2290396 | 0.84 | ALDH1A1 (0.60) | NPC1MAPTALDH1A1CYP1A2KMT2A | |
| P-Anisic Acid SCHEMBL28548631 | 0.81 | CA1 (0.62) | NPC1GAAMAPTCYP1A2L3MBTL1 | |
| SCHEMBL28557976 | 0.81 | AKR1C3 (0.54) | NPC1GAAALDH1A1TNFMMP2 | |
| SCHEMBL5217775 | 0.78 | GSK3B (0.56) | ALDH1A1CYP1A2LMNASMN1; SMN2KMT2A | |
| SCHEMBL28552099 | 0.76 | PTGS2 (0.51) | NPC1GAATP53ALDH1A1CYP1A2 | |
| SCHEMBL5215355 | 0.74 | MAPT (0.52) | NPC1MAPTALDH1A1CYP1A2L3MBTL1 | |
| SCHEMBL28560296 | 0.73 | ALDH1A1 (0.56) | ALDH1A1CYP1A2SMN1; SMN2KMT2ACASP3 | |
| SCHEMBL10427298 | 0.73 | LMNA (0.72) | NPC1GAATP53MAPTALDH1A1 | |
| SCHEMBL10427299 | 0.73 | LMNA (0.72) | NPC1GAATP53MAPTALDH1A1 | |
| SCHEMBL442090 | 0.72 | MDM2 (0.59) | NPC1MAPTALDH1A1L3MBTL1MMP2 |
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-112746289-B | Synthesis method of alkyl borate compound | 合肥工业大学 | 2021-11-09 | — | — | CN | disclosed |
| CN-112746289-A | Synthesis method of alkyl borate compound | 合肥工业大学 | 2021-05-04 | — | — | CN | disclosed |