Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR2 | P30518 | 1/20 | 0.55 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.55 |
| ▸ | PGR | P06401 | 2/20 | 0.53 |
| ▸ | IDH1 | O75874 | 1/20 | 0.52 |
| ▸ | NAMPT | P43490 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | SLC22A12 | Q96S37 | 3/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | ACLY | P53396 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.45 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.45 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.45 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.45 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.45 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29561264 | 0.84 | ACLY (0.62) | PGRACLYMEN1TSHRKMT2A | |
| SCHEMBL29561778 | 0.82 | PGR (0.60) | PGRIDH1CYP3A4CES1CYP2D6 | |
| SCHEMBL29561647 | 0.82 | PGR (0.57) | AVPR2GPR27PGRCYP3A4SLC22A12 | |
| SCHEMBL29561490 | 0.81 | KMT2A (0.57) | PGRCYP3A4SLC22A12CES1ACLY | |
| SCHEMBL29561505 | 0.80 | PGR (0.57) | GPR27PGRCYP3A4CES1ACLY | |
| SCHEMBL29561469 | 0.79 | PKM (0.64) | GPR27PGRCYP3A4CES1CYP2D6 | |
| SCHEMBL13729582 | 0.78 | CA1 (0.55) | NAMPTMEN1TSHRKMT2A | |
| SCHEMBL29562342 | 0.77 | PGR (0.72) | AVPR2GPR27PGRCYP3A4CES1 | |
| SCHEMBL29561466 | 0.77 | PGR (0.57) | GPR27PGRCYP3A4CES1CYP2D6 | |
| SCHEMBL29561494 | 0.77 | ACLY (0.60) | PGRCYP3A4CES1ACLYCYP2D6 |
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-109384694-B | SIRT6 small-molecule agonist and application thereof | 上海爱乐维生物科技有限公司 | 2022-04-05 | — | — | CN | disclosed |