Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 14/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | UGT1A4 | P22310 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3319920 | 0.74 | CYP19A1 (0.67) | CYP19A1HDAC1HDAC6LMNAHSP90AA1 | |
| SCHEMBL17159812 | 0.73 | CYP19A1 (0.80) | CYP19A1HDAC1HDAC6UGT1A4PDE4D | |
| SCHEMBL14822924 | 0.70 | CYP19A1 (0.40) | CYP19A1HDAC1HDAC6UGT1A4PDE4D | |
| SCHEMBL3732125 | 0.70 | — | — | |
| SCHEMBL2679933 | 0.69 | — | — | |
| SCHEMBL16671822 | 0.69 | CYP19A1 (0.55) | CYP19A1MAPK1LMNAHSP90AA1CYP3A4 | |
| SCHEMBL2653045 | 0.68 | — | — | |
| SCHEMBL15688800 | 0.68 | CYP19A1 (0.71) | CYP19A1HDAC1HDAC6 | |
| SCHEMBL5657617 | 0.68 | CYP19A1 (0.48) | CYP19A1EGLN3HSP90AA1 | |
| SCHEMBL3235365 | 0.67 | CYP19A1 (0.69) | CYP19A1HDAC1HDAC6 |
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-105820182-A | Thermal stable copper metal organic framework material and preparation method and application thereof | 常州大学 | 2016-08-03 | — | — | CN | disclosed |