Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 6/20 | 0.55 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 3/20 | 0.46 |
| ▸ | PPARA | Q07869 | 3/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.46 |
| ▸ | IDH1 | O75874 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.42 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6662818 | 0.84 | TSHR (0.58) | LTA4HL3MBTL1LMNACYP1A2CYP2C19 | |
| SCHEMBL1923917 | 0.83 | MAPT (0.40) | LTA4HSRD5A2L3MBTL1HTT | |
| SCHEMBL1373373 | 0.80 | LMNA (0.66) | LTA4HSRD5A2L3MBTL1LMNACYP1A2 | |
| Benzene SCHEMBL28134938 | 0.79 | CA1 (0.46) | LTA4HLMNA | |
| SCHEMBL28102434 | 0.79 | CA1 (0.46) | LTA4HLMNA | |
| SCHEMBL28337059 | 0.79 | CA1 (0.46) | LTA4HLMNA | |
| SCHEMBL78440 | 0.79 | CA1 (0.46) | LTA4HLMNA | |
| SCHEMBL27781804 | 0.79 | LMNA (0.58) | LTA4HPPARGPPARAL3MBTL1LMNA | |
| SCHEMBL4768663 | 0.77 | TDP1 (0.50) | LTA4HL3MBTL1LMNACYP1A2CYP2C19 | |
| SCHEMBL6660289 | 0.77 | TDP1 (0.50) | LTA4HL3MBTL1LMNACYP1A2CYP2C19 |
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-106146511-A | Pyrazolopyrimidine derivative, preparation method, pharmaceutical composition and purposes | 安润医药科技（苏州）有限公司 | 2016-11-23 | — | — | CN | disclosed |
| CN-104422722-B | A kind of liquid membrane electrode sensor-based system sensitive to organic boronic compounds and detection method thereof | 中国科学院烟台海岸带研究所 | 2016-08-24 | — | — | CN | disclosed |