Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | TPMT | P51580 | 5/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.32 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28226971 | 0.73 | GAA (0.44) | MAPTMEN1KMT2AHPGDCYP3A4 | |
| SCHEMBL19720102 | 0.73 | ALDH1A1 (0.33) | TDP1MAPTKDM4EALDH1A1HPGD | |
| SCHEMBL22620701 | 0.71 | ALOX5 (0.47) | TDP1MAPTMEN1KMT2ACYP3A4 | |
| SCHEMBL13056776 | 0.71 | CA1 (0.52) | TDP1MAPTMEN1KMT2AKDM4E | |
| SCHEMBL11957899 | 0.69 | ACHE (0.52) | MAPTMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL24682830 | 0.67 | NQO1 (0.32) | — | |
| SCHEMBL12844550 | 0.67 | PTGS1 (0.57) | MAPTALDH1A1RECQLCYP3A4CA1 | |
| SCHEMBL24265884 | 0.67 | KDM4E (0.42) | TDP1MAPTMEN1KMT2AKDM4E | |
| SCHEMBL27500332 | 0.66 | ERN1 (0.54) | MAPTCA1CA2 | |
| SCHEMBL28174120 | 0.65 | BRD4 (0.38) | TDP1MAPTMEN1KMT2AKDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106070208-B | A kind of application of 3,5- dinitros guaiacol salt plant growth regulator | 青岛科技大学 | 2018-06-29 | — | — | CN | disclosed |
| CN-106070208-B | A kind of application of 3,5- dinitros guaiacol salt plant growth regulator | 青岛科技大学 | 2018-06-29 | — | — | CN | disclosed |