Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 8/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 6/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.36 |
| ▸ | USP1 | O94782 | 1/20 | 0.36 |
| ▸ | WDR48 | Q8TAF3 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20937731 | 0.93 | CYP11B2 (0.38) | CHEK1CYP11B2CYP11B1CYP19A1CYP17A1 | |
| SCHEMBL20937436 | 0.92 | MAPT (0.38) | CHEK1CYP11B2CYP11B1CYP19A1CYP17A1 | |
| SCHEMBL20937403 | 0.91 | MAPT (0.42) | CHEK1CYP11B2CYP11B1CYP19A1CYP17A1 | |
| SCHEMBL20937431 | 0.91 | MAPT (0.41) | CHEK1CYP11B2CYP11B1CYP19A1CYP17A1 | |
| SCHEMBL20937722 | 0.90 | CYP11B2 (0.39) | CHEK1CYP11B2CYP11B1CYP19A1CYP17A1 | |
| SCHEMBL20937379 | 0.89 | MAPT (0.39) | CYP11B2CYP11B1CYP19A1CYP17A1USP1 | |
| SCHEMBL20937399 | 0.89 | CYP11B1 (0.40) | CYP11B2CYP11B1CYP19A1CYP17A1USP1 | |
| SCHEMBL20937426 | 0.88 | CYP11B2 (0.39) | CHEK1CYP11B2CYP11B1CYP19A1CYP17A1 | |
| SCHEMBL20937417 | 0.88 | MAPK1 (0.38) | CHEK1CYP11B2CYP11B1CYP19A1CYP17A1 | |
| SCHEMBL20937380 | 0.88 | PDE5A (0.41) | CYP11B2CYP11B1CYP19A1CYP17A1USP1 |
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-2019076844-A1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2019-04-25 | — | — | WO | disclosed |