Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.56 |
| ▸ | BAD | Q92934 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | RXRA | P19793 | 6/20 | 0.50 |
| ▸ | RXRB | P28702 | 5/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.48 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | CA3 | P07451 | 1/20 | 0.46 |
| ▸ | TYR | P14679 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA6 | P23280 | 1/20 | 0.46 |
| ▸ | CA5A | P35218 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL298629 | 0.98 | BCL2L1 (0.58) | BCL2L1BADTSHRTP53RXRA | |
| SCHEMBL28633237 | 0.95 | BCL2L1 (0.56) | BCL2L1BADTSHRTP53RXRA | |
| SCHEMBL28987693 | 0.93 | BCL2L1 (0.54) | BCL2L1BADTSHRTP53RXRA | |
| Water SCHEMBL22788424 | 0.85 | TSHR (0.75) | BCL2L1BADTSHRTP53RXRA | |
| Water SCHEMBL8605516 | 0.85 | TSHR (0.75) | BCL2L1BADTSHRTP53RXRA | |
| SCHEMBL8070391 | 0.83 | TSHR (0.61) | BCL2L1BADTSHRTP53CA12 | |
| SCHEMBL20583 | 0.83 | — | — | |
| Water SCHEMBL27988849 | 0.83 | TSHR (0.71) | BCL2L1BADTSHRTP53RXRA | |
| SCHEMBL14018385 | 0.83 | TSHR (0.80) | BCL2L1BADTSHRTP53RXRA | |
| SCHEMBL69873 | 0.83 | TSHR (0.80) | BCL2L1BADTSHRTP53RXRA |
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 |
|---|---|---|---|---|---|---|---|
| CN-113214223-B | Preparation method of Voranolan fumarate impurity | 南京海纳医药科技股份有限公司 | 2022-04-05 | — | — | CN | disclosed |
| CN-113214223-A | Preparation method of Voranolan fumarate impurity | 南京海纳医药科技股份有限公司 | 2021-08-06 | — | — | CN | disclosed |