Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDB1 | Q16531 | 1/20 | 0.44 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28534476 | 0.88 | TSHR (0.43) | ALDH1A1NPC1RAB9ATSHRKMT2A | |
| SCHEMBL28533121 | 0.80 | DDB1 (0.34) | DDB1CRBNALDH1A1TDP1NPC1 | |
| SCHEMBL15967632 | 0.80 | DDB1 (0.52) | DDB1CRBNALDH1A1TDP1CYP3A4 | |
| SCHEMBL15967719 | 0.78 | DDB1 (0.50) | DDB1CRBNALDH1A1NPC1RAB9A | |
| SCHEMBL3021875 | 0.77 | DDB1 (0.55) | DDB1CRBNALDH1A1TDP1CYP3A4 | |
| SCHEMBL29353285 | 0.75 | ALDH1A1 (0.69) | ALDH1A1TDP1NPC1RAB9ACYP3A4 | |
| SCHEMBL2705753 | 0.75 | ALDH1A1 (0.69) | ALDH1A1TDP1NPC1RAB9ACYP3A4 | |
| SCHEMBL25787780 | 0.74 | DDB1 (0.57) | DDB1CRBNALDH1A1TDP1CYP3A4 | |
| Hydrochloric Acid SCHEMBL27584631 | 0.74 | ALDH1A1 (0.67) | ALDH1A1TDP1NPC1RAB9ACYP3A4 | |
| SCHEMBL19208963 | 0.71 | DDB1 (0.53) | DDB1CRBNALDH1A1TDP1CYP3A4 |
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 |