Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | ALOX5 | P09917 | 6/20 | 0.45 |
| ▸ | TYR | P14679 | 2/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL30640325 | 0.98 | CYP19A1 (0.53) | CYP19A1HTTNPC1HPGDMAPK1 | |
| SCHEMBL5994446 | 0.94 | NPC1 (0.59) | CYP19A1HTTNPC1HPGDMAPK1 | |
| SCHEMBL28453758 | 0.88 | HPGD (0.45) | CYP19A1HTTNPC1HPGDMAPK1 | |
| SCHEMBL5678432 | 0.86 | ALOX5 (0.56) | CYP19A1HTTNPC1HPGDMAPK1 | |
| SCHEMBL573764 | 0.85 | HTT (0.48) | CYP19A1HTTNPC1HPGDMAPK1 | |
| SCHEMBL31395450 | 0.85 | HTT (0.48) | CYP19A1HTTNPC1HPGDMAPK1 | |
| SCHEMBL28571443 | 0.84 | HTT (0.47) | CYP19A1HTTNPC1HPGDMAPK1 | |
| SCHEMBL11818683 | 0.79 | HTT (0.47) | CYP19A1HTTNPC1HPGDMAPK1 | |
| SCHEMBL5676538 | 0.78 | ALOX5 (0.51) | CYP19A1HTTNPC1HPGDMAPK1 | |
| SCHEMBL3804566 | 0.77 | HTT (0.53) | CYP19A1HTTNPC1HPGDMAPK1 |
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-109988197-A | A kind of ferrocene coumarin kind compound and its preparation method and application | 合肥工业大学 | 2019-07-09 | — | — | CN | disclosed |