Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | CCR5 | P51681 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 2/20 | 0.31 |
| ▸ | MMP9 | P14780 | 2/20 | 0.31 |
| ▸ | MMP8 | P22894 | 2/20 | 0.31 |
| ▸ | MMP13 | P45452 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL198215 | 1.00 | PDK2 (0.34) | PDK2ABL1HTR7CCR5NPC1 | |
| SCHEMBL29591416 | 1.00 | PDK2 (0.34) | PDK2ABL1HTR7CCR5NPC1 | |
| SCHEMBL196978 | 1.00 | PDK2 (0.34) | PDK2ABL1HTR7CCR5NPC1 | |
| SCHEMBL196788 | 1.00 | PDK2 (0.34) | PDK2ABL1HTR7CCR5NPC1 | |
| SCHEMBL811806 | 1.00 | PDK2 (0.34) | PDK2ABL1HTR7CCR5NPC1 | |
| SCHEMBL15674381 | 0.99 | PDK2 (0.33) | PDK2ABL1HTR7CCR5NPC1 | |
| SCHEMBL26050359 | 0.97 | PDK2 (0.33) | PDK2ABL1HTR7CCR5NPC1 | |
| SCHEMBL197894 | 0.91 | LMNA (0.36) | PDK2NPC1GAANFKB1RAB9A | |
| SCHEMBL196478 | 0.91 | PDK2 (0.40) | PDK2HTR7GAASMN1; SMN2MMP2 | |
| SCHEMBL196824 | 0.91 | PDK2 (0.40) | PDK2HTR7GAASMN1; SMN2MMP2 |
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-110003271-B | Process for producing aromatic compound | 住友化学株式会社 | 2022-05-03 | — | — | CN | disclosed |