Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 3/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.33 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.33 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.33 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | RGS17 | Q9UGC6 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10704493 | 0.70 | CA2 (0.49) | PDE10AKDM4EMEN1HPGDKMT2A | |
| SCHEMBL19776164 | 0.69 | NQO2 (0.49) | NQO2CYP19A1ACHECYP1A2KDM4E | |
| SCHEMBL24149616 | 0.68 | KDM4E (0.48) | NQO2CYP1A2KDM4EMEN1ALDH1A1 | |
| SCHEMBL32669418 | 0.67 | TTBK1 (0.40) | NQO2CYP19A1ACHECYP1A2TXNRD1 | |
| SCHEMBL31184823 | 0.66 | ALDH1A1 (0.39) | KDM4EALDH1A1LMNAMAPTHPGD | |
| SCHEMBL3525845 | 0.65 | MAP2K4 (0.45) | PDE10AKDM4EMEN1ALDH1A1HPGD | |
| SCHEMBL7215930 | 0.65 | MEN1 (0.35) | KDM4EMEN1ALDH1A1LMNAMAPT | |
| SCHEMBL29162197 | 0.65 | DAO (0.39) | ACHEKDM4EMEN1ALDH1A1HPGD | |
| SCHEMBL9739366 | 0.65 | NQO2 (0.37) | NQO2CYP19A1ACHECYP1A2CYP1B1 | |
| SCHEMBL10915643 | 0.65 | NQO2 (0.41) | NQO2PDE10ACYP19A1TXNRD1TXNRD3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0138490-B1 | 4-alkyl methylenedioxy-2-1[H]-quinazolinones | ORTHO PHARMACEUTICAL CORPORATION (US) | 1988-04-27 | — | — | EP | disclosed |
| US-4617392-A | 4-alkyl-5,6-methylenedioxy-2-1[H]-quinazolinones useful as cardiotonic agents | ORTHO PHARMACEUTICAL CORPORATION (US) | 1986-10-14 | — | — | US | disclosed |
| EP-0138490-A1 | 4-alkyl methylenedioxy-2-1[H]-quinazolinones | ORTHO PHARMACEUTICAL CORPORATION (US) | 1985-04-24 | — | — | EP | disclosed |