Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 2/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.31 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL11838516 | 0.81 | ALDH1A1 (0.39) | GABRA1GABRB2ALDH1A1KDM4EHTR1A | |
| SCHEMBL15067832 | 0.81 | ATM (0.38) | ALDH1A1ADRA2CADRA2AADRA2BTSHR | |
| SCHEMBL15067445 | 0.79 | HPGD (0.33) | ALDH1A1HTR1AADRA2CADRA2AADRA2B | |
| SCHEMBL3849532 | 0.79 | HPGD (0.44) | ALDH1A1KDM4EHTR1AADRA2CADRA2A | |
| SCHEMBL3644175 | 0.77 | MAPT (0.38) | ALDH1A1HTR1ATSHRHPGDMAPK1 | |
| SCHEMBL15066329 | 0.77 | ALDH1A1 (0.40) | ALDH1A1KDM4EHTR1AADRA2CADRA2A | |
| SCHEMBL6625729 | 0.73 | MEN1 (0.31) | ADRA2CADRA2AADRA2BTSHRHPGD | |
| SCHEMBL2921706 | 0.73 | KDM4E (0.33) | ALDH1A1KDM4EADRA2CADRA2AADRA2B | |
| SCHEMBL2923138 | 0.73 | ADRB2 (0.39) | ALDH1A1TSHRHPGDMAPK1HSD17B10 | |
| SCHEMBL6945675 | 0.72 | HPGD (0.42) | ALDH1A1KDM4EHTR1ATSHRHPGD |
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-113195502-A | Macrocyclic influenza endonuclease inhibitors | 詹森生物制药有限公司 | 2021-07-30 | — | — | CN | disclosed |