Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 3/20 | 0.57 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.57 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | JUN | P05412 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.42 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10492226 | 0.79 | APP (0.43) | CYP19A1ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL496414 | 0.79 | APP (0.43) | CYP19A1ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL339509 | 0.79 | APP (0.43) | CYP19A1ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL12160281 | 0.75 | — | — | |
| SCHEMBL16215726 | 0.74 | — | — | |
| SCHEMBL5496395 | 0.73 | CYP11B2 (1.00) | CYP11B2CYP11B1CYP19A1ALDH1A1KMT2A | |
| SCHEMBL9268248 | 0.73 | CYP11B2 (1.00) | CYP11B2CYP11B1CYP19A1ALDH1A1KMT2A | |
| SCHEMBL31668803 | 0.73 | CYP11B2 (1.00) | CYP11B2CYP11B1CYP19A1ALDH1A1KMT2A | |
| SCHEMBL3142532 | 0.73 | CYP11B2 (0.68) | CYP11B2CYP11B1CYP19A1ALDH1A1KMT2A | |
| SCHEMBL14175196 | 0.71 | CYP11B2 (0.48) | CYP11B2CYP11B1CYP19A1ALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0202589-A2 | Pharmaceutical compositions containing ascorbic acid derivatives | Takeda Chemical Industries, Ltd. (JP) | 1986-11-26 | — | — | EP | disclosed |