Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 4/20 | 0.48 |
| ▸ | HTR1D | P28221 | 2/20 | 0.47 |
| ▸ | HTR1B | P28222 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | RXRB | P28702 | 4/20 | 0.41 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.41 |
| ▸ | RXRA | P19793 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | RXRG | P48443 | 1/20 | 0.37 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.37 |
| ▸ | FLT3 | P36888 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14696545 | 0.86 | POLB (0.41) | POLBHTR1DHTR1BL3MBTL1GABRA1 | |
| SCHEMBL30435110 | 0.84 | POLB (0.46) | POLBHTR1DHTR1BL3MBTL1GRIN2C | |
| SCHEMBL14988234 | 0.80 | GLRA3 (0.41) | POLBHTR1DHTR1BL3MBTL1GABRA1 | |
| SCHEMBL501930 | 0.79 | RXRB (0.50) | POLBHTR1DHTR1BL3MBTL1GABRA1 | |
| SCHEMBL112083 | 0.79 | POLB (0.44) | POLBHTR1DHTR1BGABRA1GABRB2 | |
| SCHEMBL501929 | 0.79 | POLB (0.44) | POLBHTR1DHTR1BGABRA1GABRB2 | |
| SCHEMBL8723137 | 0.78 | POLB (0.40) | POLBHTR1DHTR1BL3MBTL1GABRA1 | |
| SCHEMBL580023 | 0.78 | POLB (0.52) | POLBL3MBTL1HPGDCYP1A2ALDH1A1 | |
| SCHEMBL28949671 | 0.77 | POLB (0.43) | POLBHTR1DHTR1BL3MBTL1GABRA1 | |
| SCHEMBL4060815 | 0.77 | POLB (0.43) | POLBL3MBTL1GRIN2CCYP1A2ALDH1A1 |
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-103922966-B | As the methane amide of influenza A virus inhibitor and isonitrile compounds and preparation and application thereof | WUHAN UNIVERSITY (CN) | 2015-10-21 | — | — | CN | disclosed |