Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNE1 | P24864 | 3/20 | 0.41 |
| ▸ | CDK2 | P24941 | 3/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.41 |
| ▸ | P2RY2 | P41231 | 1/20 | 0.38 |
| ▸ | GCK | P35557 | 2/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.36 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.36 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.36 |
| ▸ | FFAR2 | O15552 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 2/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 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 | |
|---|---|---|---|---|
| SCHEMBL29353674 | 1.00 | CCNE1 (0.41) | CCNE1CDK2CDK5P2RY2GCK | |
| SCHEMBL29358389 | 0.91 | CCNE1 (0.41) | CCNE1CDK2CDK5P2RY2GCK | |
| SCHEMBL21395245 | 0.91 | CCNE1 (0.41) | CCNE1CDK2CDK5P2RY2GCK | |
| SCHEMBL21394896 | 0.83 | P2RY2 (0.42) | CCNE1CDK2CDK5P2RY2FFAR2 | |
| SCHEMBL21384235 | 0.83 | CCNE1 (0.40) | CCNE1CDK2CDK5GCK | |
| SCHEMBL29356596 | 0.83 | SCD (0.45) | CCNE1CDK2CDK5P2RY2LCK | |
| SCHEMBL21394898 | 0.83 | SCD (0.45) | CCNE1CDK2CDK5P2RY2LCK | |
| SCHEMBL21395247 | 0.82 | PSEN1 (0.48) | CCNE1CDK2CDK5P2RY2CA1 | |
| SCHEMBL29358368 | 0.81 | L3MBTL1 (0.45) | — | |
| SCHEMBL19003723 | 0.81 | CCNE1 (0.42) | CCNE1CDK2CDK5P2RY2FFAR2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114845709-A | MRGPRX2 antagonists for use in treating inflammatory disorders | 德米拉公司 | 2022-08-02 | — | — | CN | disclosed |
| WO-2020198026-A1 | COMPOUNDS AND USES THEREOF | YUMANITY THERAPEUTICS, INC. (US) | 2020-10-01 | — | — | WO | disclosed |
| WO-2019183587-A1 | COMPOUNDS AND USES THEREOF | YUMANITY THERAPEUTICS, INC. (US) | 2019-09-26 | — | — | WO | disclosed |