Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MDM2 | Q00987 | 3/20 | 0.61 |
| ▸ | ESR1 | P03372 | 1/20 | 0.58 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8011269 | 0.91 | ESR1 (0.58) | MDM2ESR1ESR2PTGS2GAA | |
| SCHEMBL10041260 | 0.89 | ESR1 (0.67) | MDM2ESR1ESR2PTGS2GAA | |
| SCHEMBL2327124 | 0.85 | GAA (0.56) | MDM2ESR1ESR2GAAMEN1 | |
| SCHEMBL541157 | 0.84 | ESR2 (0.78) | ESR1ESR2PTGS2GAAMEN1 | |
| SCHEMBL25769018 | 0.84 | ESR1 (0.60) | MDM2ESR1ESR2PTGS2GAA | |
| SCHEMBL22926671 | 0.84 | ESR1 (0.60) | ESR1ESR2GAAMEN1KMT2A | |
| SCHEMBL15033629 | 0.84 | ESR1 (0.60) | MDM2ESR1ESR2PTGS2GAA | |
| SCHEMBL8011006 | 0.83 | ESR1 (0.72) | ESR1ESR2PTGS2GAAMEN1 | |
| SCHEMBL8022202 | 0.83 | PTGS2 (0.69) | ESR1ESR2PTGS2MEN1KMT2A | |
| SCHEMBL12135391 | 0.83 | ESR1 (0.59) | MDM2ESR1ESR2GAAMEN1 |
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-110283134-A | A kind of triazine benzene derivative and its application | 武汉尚赛光电科技有限公司 | 2019-09-27 | — | — | CN | disclosed |