Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 1/20 | 0.46 |
| ▸ | ABL1 | P00519 | 2/20 | 0.46 |
| ▸ | BCR | P11274 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | ERN1 | O75460 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3833937 | 0.82 | PDE4A (0.48) | CALM1ABL1BCRALOX5CYP3A4 | |
| SCHEMBL2002047 | 0.81 | CALM1 (0.46) | CALM1ABL1BCRALOX5CYP3A4 | |
| SCHEMBL2002048 | 0.81 | CYP1A2 (0.51) | CALM1ABL1BCRALOX5CYP3A4 | |
| SCHEMBL18987306 | 0.79 | ALOX5 (0.73) | ALOX5PTGS2CYP1A2 | |
| SCHEMBL1047550 | 0.79 | ABL1 (0.65) | ABL1BCRALOX5CYP3A4ERN1 | |
| SCHEMBL18342948 | 0.78 | ALOX5 (0.74) | ALOX5PTGS2CYP1A2 | |
| SCHEMBL29711563 | 0.78 | ALOX5 (0.74) | ALOX5PTGS2CYP1A2 | |
| SCHEMBL21558842 | 0.78 | ALOX5 (0.74) | ALOX5PTGS2CYP1A2 | |
| Hydrochloric Acid SCHEMBL11247046 | 0.77 | APLNR (0.46) | CALM1ABL1BCRALOX5CYP1A2 | |
| SCHEMBL11854329 | 0.77 | CALM1 (0.43) | CALM1ABL1BCRALOX5CYP3A4 |
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-109369599-A | A kind of xanthene ketone compounds and its preparation method and application | 广州医科大学 | 2019-02-22 | — | — | CN | disclosed |