Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 6/20 | 0.44 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | AHR | P35869 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL26192829 | 0.88 | MAPT (0.48) | CYP19A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL1852084 | 0.85 | IDO1 (0.61) | LMNAMAPTMEN1KMT2AIDO1 | |
| SCHEMBL3014712 | 0.84 | MAPT (0.49) | LMNAMAPTMEN1KMT2ASMN1; SMN2 | |
| Bicarbonate SCHEMBL28486866 | 0.78 | POLB (0.45) | MAPTMEN1KMT2ASMN1; SMN2TDP1 | |
| SCHEMBL27844926 | 0.78 | MAPT (0.48) | LMNAMAPTMEN1KMT2ATSHR | |
| SCHEMBL3367925 | 0.77 | HSPB1 (0.51) | MAPTMEN1KMT2ATDP1POLB | |
| SCHEMBL27825929 | 0.77 | MAPT (0.47) | LMNAMAPTMEN1KMT2ATSHR | |
| SCHEMBL27858187 | 0.76 | MAPT (0.44) | LMNAMAPTMEN1KMT2AIDO1 | |
| SCHEMBL28313237 | 0.76 | — | — | |
| SCHEMBL8809569 | 0.73 | MAPT (0.52) | MAPTMEN1KMT2AIDO1TSHR |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112402425-A | Application of 3, 5-dinitrophenyl-pyrazolo [3,4-d ] [1,3] oxazine as tumor drug resistance reversal agent | 山东师范大学 | 2021-02-26 | — | — | CN | claimed |
| CN-104710363-A | Energetic compound 1-(2,2,2-trinitroethylamino)-3,5-dinitropyrazole and preparation method thereof | INST CHEMICAL MATERIAL CHINA ACADEMY ENGINEERING PHYSICS | 2015-06-17 | — | — | CN | claimed |
| CN-112402425-B | Application of 3, 5-dinitrophenyl-pyrazolo [3,4-d ] [1,3] oxazine as tumor drug resistance reversal agent | 山东师范大学 | 2021-12-03 | — | — | CN | disclosed |
| CN-112402425-B | Application of 3, 5-dinitrophenyl-pyrazolo [3,4-d ] [1,3] oxazine as tumor drug resistance reversal agent | 山东师范大学 | 2021-12-03 | — | — | CN | disclosed |
| CN-112402425-B | Application of 3, 5-dinitrophenyl-pyrazolo [3,4-d ] [1,3] oxazine as tumor drug resistance reversal agent | 山东师范大学 | 2021-12-03 | — | — | CN | disclosed |
| CN-112402425-A | Application of 3, 5-dinitrophenyl-pyrazolo [3,4-d ] [1,3] oxazine as tumor drug resistance reversal agent | 山东师范大学 | 2021-02-26 | — | — | CN | disclosed |
| CN-112402425-A | Application of 3, 5-dinitrophenyl-pyrazolo [3,4-d ] [1,3] oxazine as tumor drug resistance reversal agent | 山东师范大学 | 2021-02-26 | — | — | CN | disclosed |
| CN-112402425-A | Application of 3, 5-dinitrophenyl-pyrazolo [3,4-d ] [1,3] oxazine as tumor drug resistance reversal agent | 山东师范大学 | 2021-02-26 | — | — | CN | disclosed |
| CN-104710363-A | Energetic compound 1-(2,2,2-trinitroethylamino)-3,5-dinitropyrazole and preparation method thereof | INST CHEMICAL MATERIAL CHINA ACADEMY ENGINEERING PHYSICS | 2015-06-17 | — | — | CN | disclosed |
| CN-103298805-A | Quinazoline compounds and methods of use thereof | AMBIT BIOSCIENCES CORP | 2013-09-11 | — | — | CN | disclosed |
| CN-102250007-A | Preparation method of 3,4-binitropyrazole | UNIV NORTH CHINA | 2011-11-23 | — | — | CN | disclosed |
| CN-101195672-B | Method for producing olefin-copolymerization catalyst and method for producing olefin-copolymers | SUMITOMO CHEMICAL CO | 2011-07-06 | — | — | CN | disclosed |
| CN-101195672-A | Method for producing olefin-copolymerization catalyst and method for producing olefin-copolymers | SUMITOMO CHEMICAL CO (JP) | 2008-06-11 | — | — | CN | disclosed |