Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 2/20 | 0.51 |
| ▸ | RXRB | P28702 | 1/20 | 0.51 |
| ▸ | RXRG | P48443 | 1/20 | 0.51 |
| ▸ | PTPN5 | P54829 | 2/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.44 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.44 |
| ▸ | CDK8 | P49336 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MDM4 | O15151 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | TYR | P14679 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15340959 | 0.83 | RXRA (0.50) | RXRARXRBRXRGPTPN5HSD17B1 | |
| SCHEMBL19772854 | 0.81 | RXRA (0.49) | RXRARXRBRXRGPTPN5HSD17B1 | |
| SCHEMBL24721140 | 0.81 | RXRA (0.49) | RXRARXRBRXRGPTPN5HSD17B1 | |
| SCHEMBL1838727 | 0.80 | CYP2A6 (0.50) | RXRARXRBRXRGPTPN5HSD17B1 | |
| SCHEMBL23951753 | 0.80 | RXRA (0.47) | RXRARXRBRXRGPTPN5CDK8 | |
| SCHEMBL13524637 | 0.80 | MAP4K4 (0.62) | RXRARXRBRXRGPTPN5MAP4K4 | |
| SCHEMBL18790919 | 0.79 | HSD17B1 (0.50) | RXRARXRBRXRGPTPN5HSD17B1 | |
| SCHEMBL14875669 | 0.78 | RXRA (0.61) | RXRARXRBRXRGPTPN5HSD17B1 | |
| SCHEMBL24721003 | 0.78 | PSEN1 (0.53) | RXRARXRBRXRGPTPN5CDK8 | |
| SCHEMBL19772885 | 0.78 | RXRA (0.45) | RXRARXRBRXRGPTPN5HSD17B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022234965-A1 | HETEROARYL DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT | 주식회사 보로노이 | 2022-11-10 | — | — | WO | disclosed |