Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.38 |
| ▸ | SLC28A3 | Q9HAS3 | 2/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4133119 | 0.85 | CYP3A4 (0.43) | CYP3A4KMT2AUSP2MAPK1SMN1; SMN2 | |
| SCHEMBL26481059 | 0.84 | CYP3A4 (0.54) | CYP3A4KMT2AUSP2MAPK1SMN1; SMN2 | |
| SCHEMBL30792317 | 0.83 | CYP3A4 (0.58) | CYP3A4MEN1KMT2AHPGDUSP2 | |
| SCHEMBL656327 | 0.83 | CYP3A4 (0.58) | CYP3A4MEN1KMT2AHPGDUSP2 | |
| SCHEMBL30350587 | 0.82 | CYP3A4 (0.71) | CYP3A4MEN1KMT2AHPGDUSP2 | |
| SCHEMBL26481061 | 0.82 | CYP3A4 (0.71) | CYP3A4MEN1KMT2AHPGDUSP2 | |
| SCHEMBL15731843 | 0.81 | CYP3A4 (0.37) | CYP3A4MEN1KMT2AHPGDUSP2 | |
| SCHEMBL12375248 | 0.81 | CYP3A4 (0.51) | CYP3A4KMT2AUSP2MAPK1SMN1; SMN2 | |
| SCHEMBL23327309 | 0.81 | CYP3A4 (0.47) | CYP3A4MEN1KMT2AUSP2MAPK1 | |
| SCHEMBL30545309 | 0.81 | CYP3A4 (0.60) | CYP3A4KMT2AUSP2MAPK1SMN1; SMN2 |
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-2021182896-A1 | INDUCED BROWN FAT DIFFERENTIATION COMPOSITION COMPRISING ISOLIQUIRITIGENIN DERIVATIVE | 가톨릭관동대학교산학협력단 | 2021-09-16 | — | — | WO | disclosed |