Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.34 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.33 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.33 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17029033 | 0.93 | NR1I2 (0.39) | NR1I2DGAT1SOAT1GABRA2GABRB2 | |
| SCHEMBL17029006 | 0.93 | NR1I2 (0.41) | NR1I2L3MBTL1TP53MAPTPDE4B | |
| SCHEMBL17029005 | 0.90 | NR1I2 (0.42) | NR1I2PDE4APDE4BPDE4CKDM4E | |
| SCHEMBL20344833 | 0.90 | NR1I2 (0.41) | NR1I2PDE4APDE4BPDE4CKMT2A | |
| SCHEMBL17039259 | 0.89 | NR1I2 (0.39) | NR1I2L3MBTL1TRPM8TP53MAPT | |
| SCHEMBL17039244 | 0.88 | NR1I2 (0.42) | NR1I2GABRA2GABRB2L3MBTL1BCHE | |
| SCHEMBL20344788 | 0.88 | NR1I2 (0.42) | NR1I2GABRA2GABRB2L3MBTL1BCHE | |
| SCHEMBL20344789 | 0.86 | NR1I2 (0.37) | NR1I2MAPTKDM4EALDH1A1HPGD | |
| SCHEMBL17039260 | 0.85 | NR1I2 (0.50) | NR1I2 | |
| SCHEMBL17029021 | 0.83 | NR1I2 (0.45) | NR1I2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9938271-B2 | Inhibitors of human immunodeficiency virus replication | VIIV Healthcare UK (No.5) Limited (GB) | 2018-04-10 | — | — | US | disclosed |