Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.36 |
| ▸ | LIMK1 | P53667 | 3/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28308671 | 0.77 | CHEK1 (0.42) | KMT2APTGS1PTGS2LRRK2ALDH1A1 | |
| SCHEMBL4201172 | 0.76 | PDXK (0.33) | ALDH1A1BTKIDO1 | |
| SCHEMBL5974760 | 0.70 | — | — | |
| SCHEMBL24109687 | 0.70 | CYP3A4 (0.38) | ALDH1A1SMN1; SMN2TSHRBTKHPGD | |
| SCHEMBL9160147 | 0.68 | NOS2 (0.48) | BTK | |
| SCHEMBL15731251 | 0.67 | PDE2A (0.48) | POLBKMT2AHSD11B1ALDH1A1PLA2G7 | |
| SCHEMBL4624037 | 0.67 | CCR1 (0.35) | — | |
| SCHEMBL30296511 | 0.67 | CCR1 (0.35) | — | |
| SCHEMBL10768091 | 0.67 | NFE2L2 (0.46) | ALDH1A1SMN1; SMN2IDO1GRM5HPGD | |
| SCHEMBL23198751 | 0.66 | PLA2G7 (0.50) | POLBKMT2AHSD11B1ALDH1A1PLA2G7 |
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-109956898-A | Immunomodulator and its preparation method and purposes pharmaceutically | 上海海雁医药科技有限公司 | 2019-07-02 | — | — | CN | disclosed |