Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 5/20 | 0.41 |
| ▸ | CCND1 | P24385 | 5/20 | 0.41 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | CCND3 | P30281 | 1/20 | 0.41 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.39 |
| ▸ | CCR9 | P51686 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KDM5A | P29375 | 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 | |
|---|---|---|---|---|
| SCHEMBL24571282 | 1.00 | CDK4 (0.41) | CDK4CCND1CCNE1CDK2CCND3 | |
| SCHEMBL29367884 | 0.79 | L3MBTL1 (0.49) | KMT2ACYP11B2CCR9TP53MEN1 | |
| SCHEMBL25207020 | 0.79 | L3MBTL1 (0.49) | KMT2ACYP11B2CCR9TP53MEN1 | |
| SCHEMBL21274000 | 0.79 | CCR9 (0.35) | CDK4CCND1CCNE1CDK2CCND3 | |
| SCHEMBL21273996 | 0.79 | CCR9 (0.35) | CDK4CCND1CCNE1CDK2CCND3 | |
| SCHEMBL29641293 | 0.79 | ROCK2 (0.47) | KMT2ACCR9MEN1ALDH1A1L3MBTL1 | |
| SCHEMBL18938861 | 0.79 | ROCK2 (0.47) | KMT2ACCR9MEN1ALDH1A1L3MBTL1 | |
| SCHEMBL20425411 | 0.76 | CDK4 (0.53) | CDK4CCND1CCNE1CDK2CCND3 | |
| SCHEMBL31372001 | 0.76 | CDK4 (0.53) | CDK4CCND1CCNE1CDK2CCND3 | |
| SCHEMBL24571361 | 0.73 | CYP11B2 (0.40) | CYP11B2CYP11B1CCR9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4267562-A1 | INHIBITORS OF PEPTIDYLARGININE DEIMINASES | GILEAD SCIENCES, INC. (US) | 2023-11-01 | — | — | EP | disclosed |
| WO-2022140390-A1 | INHIBITORS OF PEPTIDYLARGININE DEIMINASES | GILEAD SCIENCES, INC. (US) | 2022-06-30 | — | — | WO | disclosed |