Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.53 |
| ▸ | CES1 | P23141 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | F2 | P00734 | 1/20 | 0.45 |
| ▸ | ACP3 | P15309 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | PTPRC | P08575 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL6006252 | 0.91 | CES2 (0.64) | CES2CES1MEN1KMT2ATSHR | |
| SCHEMBL28058502 | 0.84 | TSHR (0.50) | MEN1KMT2ATSHRLMNANPSR1 | |
| SCHEMBL1759204 | 0.84 | CA1 (0.64) | CES2CES1MEN1KMT2ATSHR | |
| SCHEMBL1759207 | 0.84 | CA1 (0.64) | CES2CES1MEN1KMT2ATSHR | |
| SCHEMBL8582923 | 0.81 | NPSR1 (0.60) | CES2CES1MEN1KMT2ATSHR | |
| SCHEMBL1134005 | 0.81 | CES1 (0.80) | CES2CES1MEN1KMT2ATSHR | |
| SCHEMBL28200751 | 0.81 | MEN1 (0.50) | CES2CES1MEN1KMT2ATSHR | |
| SCHEMBL5487184 | 0.80 | TSHR (0.57) | CES2CES1MEN1KMT2ATSHR | |
| SCHEMBL27666671 | 0.78 | NPSR1 (0.53) | CES2CES1MEN1KMT2ATSHR | |
| SCHEMBL28574633 | 0.78 | MEN1 (0.53) | CES2CES1MEN1KMT2ATSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105541901-A | Preparation method for 2,4-dichloro-5-nitrophenyl phosphotriester | Hefei xingyu chemical co ltd | 2016-05-04 | — | — | CN | claimed |
| CN-105541901-B | A kind of preparation method of bis- chloro- three esters of 5- nitrophenylphosphates of 2,4- | 合肥星宇化学有限责任公司 | 2018-08-28 | — | — | CN | disclosed |
| CN-105541901-A | Preparation method for 2,4-dichloro-5-nitrophenyl phosphotriester | Hefei xingyu chemical co ltd | 2016-05-04 | — | — | CN | disclosed |