Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | RBP4 | P02753 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9578253 | 0.83 | RBP4 (0.38) | HSD17B10PIN1PTGDR2AKR1C3AKR1C1 | |
| SCHEMBL7357951 | 0.83 | ALDH1A1 (0.41) | HSD17B10PIN1PTGDR2AKR1C3AKR1C1 | |
| SCHEMBL4443007 | 0.81 | SLC6A2 (0.40) | HSD17B10PIN1PTGDR2AKR1C3AKR1C1 | |
| SCHEMBL4109572 | 0.81 | ALDH1A1 (0.54) | AKR1C3AKR1C1CYP2D6ALDH1A1ALOX15 | |
| SCHEMBL10457353 | 0.81 | ALDH1A1 (0.54) | AKR1C3AKR1C1CYP2D6ALDH1A1ALOX15 | |
| SCHEMBL30175300 | 0.81 | ALDH1A1 (0.54) | AKR1C3AKR1C1CYP2D6ALDH1A1ALOX15 | |
| SCHEMBL16025390 | 0.79 | NOTUM (0.42) | HSD17B10PIN1ALDH1A1NOTUMNPC1 | |
| SCHEMBL161548 | 0.79 | ADRA1A (0.51) | HSD17B10ALDH1A1NPC1ADRA1ARAB9A | |
| SCHEMBL16654184 | 0.79 | ALDH1A1 (0.47) | HSD17B10PIN1PTGDR2AKR1C3AKR1C1 | |
| SCHEMBL29932760 | 0.79 | NOTUM (0.42) | HSD17B10PIN1ALDH1A1NOTUMNPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4136084-A1 | BCL-2 INHIBITOR | BeiGene, Ltd. (KY) | 2023-02-22 | — | — | EP | disclosed |
| WO-2021208963-A1 | BCL-2 INHIBITOR | BEIGENE, LTD. (KY) | 2021-10-21 | — | — | WO | disclosed |