Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 1/20 | 0.55 |
| ▸ | CCND1 | P24385 | 1/20 | 0.55 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.52 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.50 |
| ▸ | JUN | P05412 | 1/20 | 0.50 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA4 | P22748 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | GUSB | P08236 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11189518 | 0.84 | CDK4 (0.59) | CDK4CCND1TRIM24TRIM33NFKB1 | |
| SCHEMBL4453048 | 0.81 | TRPA1 (0.47) | CDK4CCND1TRIM24TRIM33NFKB1 | |
| SCHEMBL3415700 | 0.78 | CA2 (0.50) | CDK4CCND1TRIM24TRIM33NFKB1 | |
| SCHEMBL3415698 | 0.78 | CA2 (0.50) | CDK4CCND1TRIM24TRIM33NFKB1 | |
| SCHEMBL347703 | 0.78 | TRPA1 (0.48) | CDK4CCND1TRIM24TRIM33NFKB1 | |
| SCHEMBL30337793 | 0.78 | CA2 (0.50) | CDK4CCND1TRIM24TRIM33NFKB1 | |
| SCHEMBL9164566 | 0.78 | NFKB1 (0.47) | CDK4CCND1TRIM24TRIM33NFKB1 | |
| SCHEMBL9164563 | 0.78 | NFKB1 (0.47) | CDK4CCND1TRIM24TRIM33NFKB1 | |
| SCHEMBL9574440 | 0.78 | NFKB1 (0.55) | CDK4CCND1TRIM24TRIM33NFKB1 | |
| SCHEMBL348173 | 0.76 | TRPA1 (0.46) | CDK4CCND1TRIM24TRIM33NFKB1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108530427-A | A kind of 1,4- pentadiene -3- ketoxime ethers derivative, preparation method and application containing quinazoline | 贵州大学 | 2018-09-14 | — | — | CN | disclosed |
| CN-1038586-C | Pyrazine derivatives and process for preparing same | OTSUKA PHARMA CO LTD (JP) | 1998-06-03 | — | — | CN | disclosed |
| US-5459142-A | Autoimmune disease, atherosclerosis, antiischemic agents and nephritis | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1995-10-17 | — | — | US | disclosed |
| EP-0511879-B1 | Pyrazine derivatives | OTSUKA PHARMA CO LTD (JP) | 1995-03-22 | — | — | EP | disclosed |
| EP-0511879-A1 | Pyrazine derivatives | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1992-11-04 | — | — | EP | disclosed |