Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | PLK1 | P53350 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 2/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.42 |
| ▸ | TACR2 | P21452 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SHBG | P04278 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8089720 | 0.83 | CA2 (0.48) | CA2CA1PLK1HPGDALDH1A1 | |
| SCHEMBL3921598 | 0.81 | HTR2A (0.52) | CA2CA1PLK1HPGDALDH1A1 | |
| SCHEMBL18242979 | 0.80 | PTPN2 (0.38) | — | |
| SCHEMBL18242918 | 0.80 | PTPN2 (0.42) | PLK1LMNAENPP2 | |
| SCHEMBL28088634 | 0.79 | TP53 (0.40) | CA2PLK1HPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL18242806 | 0.78 | PTPN2 (0.44) | ALDH1A1LMNAENPP2THRATHRB | |
| SCHEMBL28088854 | 0.78 | LPL (0.42) | HPGDLPLLIPGNPC1RAB9A | |
| SCHEMBL83869 | 0.78 | CA2 (0.65) | CA2CA1PLK1HPGDALDH1A1 | |
| SCHEMBL20956952 | 0.77 | CA2 (0.50) | CA2CA1PLK1HPGDALDH1A1 | |
| SCHEMBL547838 | 0.77 | KCNH2 (0.60) | CA2CA1PLK1HPGDALDH1A1 |
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-105764885-A | Acid- and radical-generating agent and method for generating acid and radical | 和光纯药工业株式会社 | 2016-07-13 | — | — | CN | disclosed |