Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL30028627 | 0.90 | MAPT (0.68) | RAB9AGAAMAPTNPSR1SMN1; SMN2 | |
| SCHEMBL10150650 | 0.88 | MAPT (0.53) | RAB9AGAAMAPTNPSR1KMT2A | |
| SCHEMBL10150645 | 0.88 | SMN1; SMN2 (0.51) | RAB9AGAAMAPTNPSR1KMT2A | |
| SCHEMBL1883985 | 0.86 | SMN1; SMN2 (0.55) | RAB9AGAAMAPTKMT2ASMN1; SMN2 | |
| SCHEMBL28702025 | 0.86 | MAPT (0.52) | RAB9AGAAMAPTSMN1; SMN2HTT | |
| SCHEMBL8430653 | 0.86 | RAB9A (0.59) | RAB9AGAAMAPTNPSR1KMT2A | |
| SCHEMBL25311260 | 0.85 | MAPT (0.51) | RAB9AGAAMAPTSMN1; SMN2HTT | |
| SCHEMBL1577128 | 0.85 | MAPT (0.51) | RAB9AGAAMAPTKMT2ASMN1; SMN2 | |
| SCHEMBL24434966 | 0.85 | RAB9A (0.58) | RAB9AGAAMAPTNPSR1KMT2A | |
| SCHEMBL1882047 | 0.84 | MAPT (0.53) | RAB9AGAAMAPTSMN1; SMN2KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103880749-B | A kind of chemical synthesis process of 3- methyl -5- pyrazole carboxylic acid methyl esters | 南通大学 | 2019-01-01 | — | — | CN | claimed |
| CN-103880749-B | A kind of chemical synthesis process of 3- methyl -5- pyrazole carboxylic acid methyl esters | 南通大学 | 2019-01-01 | — | — | CN | disclosed |
| CN-103880749-A | Chemical synthesis method of methyl 3-methyl-5-pyrazolylformate | UNIV NANTONG | 2014-06-25 | — | — | CN | disclosed |