Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5081895 | 0.81 | NCEH1 (0.49) | LMNACYP3A4MEN1KMT2AMAPT | |
| SCHEMBL545148 | 0.80 | CYP3A4 (0.58) | LMNACYP3A4TSHRMEN1KMT2A | |
| SCHEMBL776644 | 0.78 | TSHR (0.70) | LMNACYP3A4TSHRMEN1KMT2A | |
| SCHEMBL11177722 | 0.76 | MEN1 (0.61) | LMNACYP3A4TSHRMEN1KMT2A | |
| SCHEMBL11839604 | 0.76 | LMNA (0.44) | LMNACYP3A4TSHRMEN1KMT2A | |
| SCHEMBL4140665 | 0.76 | HPGD (0.55) | LMNACYP3A4TSHRMEN1KMT2A | |
| SCHEMBL7028978 | 0.76 | LMNA (0.44) | LMNACYP3A4TSHRMEN1KMT2A | |
| SCHEMBL28577183 | 0.76 | CYP3A4 (0.43) | LMNACYP3A4TSHRMEN1KMT2A | |
| SCHEMBL1902930 | 0.76 | CES2 (0.53) | LMNACYP3A4TSHRMEN1KMT2A | |
| SCHEMBL2472746 | 0.76 | SRC (0.60) | LMNAMEN1KMT2AMAPK1MAPT |
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-104926871-A | O,O-dialkyl-alpha-[3-bromo-1-(3-chloro-2-pyridyl)-1H-pyrazole-5-formyl]alkyl methylphosphonate derivative as well as preparation method and application thereof | XIAN MODERN CHEMISTRY RES INST | 2015-09-23 | — | — | CN | disclosed |