Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | ATR | Q13535 | 11/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.38 |
| ▸ | PARP11 | Q9NR21 | 2/20 | 0.38 |
| ▸ | PRKDC | P78527 | 3/20 | 0.37 |
| ▸ | ATM | Q13315 | 3/20 | 0.37 |
| ▸ | CDK4 | P11802 | 2/20 | 0.37 |
| ▸ | CCND1 | P24385 | 2/20 | 0.37 |
| ▸ | CCND3 | P30281 | 2/20 | 0.37 |
| ▸ | CDK6 | Q00534 | 2/20 | 0.37 |
| ▸ | CDK2 | P24941 | 2/20 | 0.36 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.36 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.36 |
| ▸ | CDK7 | P50613 | 1/20 | 0.36 |
| ▸ | CDK9 | P50750 | 1/20 | 0.36 |
| ▸ | CCNH | P51946 | 1/20 | 0.36 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.36 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12496279 | 0.93 | MAPK1 (0.42) | MAPK1KCNH2ATRPARP10PARP11 | |
| SCHEMBL18936961 | 0.88 | MAPK1 (0.40) | MAPK1KCNH2ATRPARP10PARP11 | |
| SCHEMBL12077162 | 0.88 | KCNH2 (0.41) | MAPK1KCNH2ATRPRKDCATM | |
| SCHEMBL12495512 | 0.88 | MAPK1 (0.39) | MAPK1KCNH2PARP10PARP11CDK4 | |
| SCHEMBL12496255 | 0.86 | MAPK1 (0.39) | MAPK1KCNH2ATRPARP10PARP11 | |
| SCHEMBL12495648 | 0.85 | MAPK1 (0.41) | MAPK1KCNH2ATRPARP10PARP11 | |
| SCHEMBL12077869 | 0.85 | MAPK1 (0.46) | MAPK1KCNH2ATRPARP10PARP11 | |
| SCHEMBL18936992 | 0.85 | MAPK1 (0.43) | MAPK1KCNH2ATRPARP10PARP11 | |
| SCHEMBL18936949 | 0.85 | MAPK1 (0.44) | MAPK1KCNH2ATRPARP10PARP11 | |
| SCHEMBL12495170 | 0.84 | MAPK1 (0.45) | MAPK1KCNH2ATRPARP10PARP11 |
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-2681206-B1 | MST1 KINASE INHIBITORS AND METHODS OF THEIR USE | LEXICON PHARMACEUTICALS INC (US) | 2017-06-14 | — | — | EP | disclosed |
| EP-2681206-A1 | MST1 KINASE INHIBITORS AND METHODS OF THEIR USE | Lexicon Pharmaceuticals, Inc. (US) | 2014-01-08 | — | — | EP | disclosed |
| WO-2012121992-A1 | MST1 KINASE INHIBITORS AND METHODS OF THEIR USE | LEXICON PHARMACEUTICALS, INC. (US) | 2012-09-13 | — | — | WO | disclosed |