Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.52 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.52 |
| ▸ | COMT | P21964 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | PSD | A5PKW4 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | PTPRF | P10586 | 1/20 | 0.44 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29110788 | 0.95 | MAPT (0.51) | CYP11B1CYP11B2COMTMAPTMEN1 | |
| SCHEMBL28171521 | 0.82 | CYP11B1 (0.66) | CYP11B1CYP11B2COMTPOLBRAB9A | |
| SCHEMBL28030908 | 0.81 | CPA1 (0.46) | MAPTMEN1KMT2APOLBNPC1 | |
| SCHEMBL27963148 | 0.78 | MAPT (0.39) | CYP11B1CYP11B2MAPTMEN1KMT2A | |
| SCHEMBL9975998 | 0.77 | RAB9A (0.76) | MAPTMEN1KMT2APOLBNPC1 | |
| SCHEMBL1249806 | 0.77 | RAB9A (0.76) | MAPTMEN1KMT2APOLBNPC1 | |
| SCHEMBL27789664 | 0.76 | MAPT (0.48) | MAPTMEN1KMT2APOLBNPC1 | |
| SCHEMBL5096712 | 0.74 | CYP11B1 (0.59) | CYP11B1CYP11B2COMTPOLBRAB9A | |
| SCHEMBL5103972 | 0.73 | CYP2D6 (0.67) | CYP11B1CYP11B2COMTLMNAHPGD | |
| SCHEMBL267666 | 0.72 | ALDH1A1 (0.70) | MAPTMEN1KMT2APOLBLMNA |
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-107162975-A | A kind of method that pyrazole compound is prepared in solvent-recoverable | 安顺学院 | 2017-09-15 | — | — | CN | disclosed |