Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 5/20 | 0.47 |
| ▸ | CES2 | O00748 | 4/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24827501 | 0.80 | NFE2L2 (0.57) | CES1CES2MEN1KMT2AMAPT | |
| SCHEMBL27346395 | 0.80 | NFE2L2 (0.57) | CES1CES2MEN1KMT2AMAPT | |
| Hydrochloric Acid SCHEMBL27320823 | 0.78 | NFE2L2 (0.55) | CES1CES2MEN1KMT2AMAPT | |
| SCHEMBL9077771 | 0.78 | CES2 (0.46) | CES1CES2PTPN1GSK3BMEN1 | |
| SCHEMBL7258488 | 0.78 | CES2 (0.46) | CES1CES2PTPN1GSK3BMEN1 | |
| SCHEMBL2919973 | 0.77 | NFE2L2 (0.46) | CES1CES2PTPN1GSK3BMEN1 | |
| SCHEMBL27321840 | 0.77 | MEN1 (0.47) | CES1CES2GSK3BMEN1KMT2A | |
| SCHEMBL9487727 | 0.77 | MAPT (0.50) | MEN1KMT2AMAPTSMN1; SMN2LMNA | |
| Hydrochloric Acid SCHEMBL27314774 | 0.76 | MEN1 (0.46) | CES1CES2GSK3BMEN1KMT2A | |
| SCHEMBL28084535 | 0.74 | NFE2L2 (0.43) | CES1CES2PTPN1GSK3BMEN1 |
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-105061504-A | Preparation method of P-alkynyl phosphate compound | UNIV HUNAN | 2015-11-18 | — | — | CN | disclosed |