Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDB1 | Q16531 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | SCN1A | P35498 | 1/20 | 0.32 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.32 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 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 | |
|---|---|---|---|---|
| SCHEMBL28533037 | 0.91 | CCR6 (0.33) | ALDH1A1NPC1RAB9AL3MBTL1TSHR | |
| SCHEMBL28529036 | 0.80 | DDB1 (0.44) | DDB1CRBNALDH1A1TDP1NPC1 | |
| SCHEMBL15166859 | 0.78 | DDB1 (0.43) | DDB1CRBNALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL17174550 | 0.77 | DDB1 (0.39) | DDB1CRBNALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL17174551 | 0.77 | DDB1 (0.39) | DDB1CRBNALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL17174548 | 0.77 | DDB1 (0.39) | DDB1CRBNALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL17162572 | 0.76 | DDB1 (0.38) | DDB1CRBNALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL17174481 | 0.76 | DDB1 (0.38) | DDB1CRBNALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL17174477 | 0.76 | DDB1 (0.38) | DDB1CRBNALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL19208974 | 0.75 | KMT2A (0.41) | DDB1CRBNALDH1A1TDP1RAB9A |
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-109153700-B | C-3 and C-17 modified triterpenoids as HIV-1 inhibitors | VIIV保健英国第五有限公司 | 2021-03-09 | — | — | CN | disclosed |