Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 2/20 | 0.54 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.51 |
| ▸ | MKNK1 | Q9BUB5 | 7/20 | 0.49 |
| ▸ | MKNK2 | Q9HBH9 | 7/20 | 0.49 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.44 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | PRKCG | P05129 | 1/20 | 0.43 |
| ▸ | PRKACA | P17612 | 1/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.43 |
| ▸ | GSK3A | P49840 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | PRKX | P51817 | 1/20 | 0.43 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4772421 | 0.84 | CAMK2D (0.54) | MKNK1MKNK2CYP2D6ROCK1MAPK1 | |
| SCHEMBL6306083 | 0.82 | CYP2D6 (0.45) | MAP4K4CYP2D6MAPK10ROCK1MAPK1 | |
| SCHEMBL1445168 | 0.81 | FYN (0.52) | MAPK1GSK3BFYN | |
| SCHEMBL9903935 | 0.80 | CYP2D6 (0.60) | MAP4K4CYP2D6MAPK10ROCK1MAPK1 | |
| SCHEMBL5270117 | 0.79 | NNMT (0.43) | MAP4K4CYP17A1MKNK1MKNK2CHEK2 | |
| SCHEMBL27913276 | 0.78 | CYP2D6 (0.53) | CYP2D6ROCK1MAPK1ROCK2CYP3A4 | |
| SCHEMBL29138051 | 0.78 | AR (0.41) | MAP4K4CYP17A1MKNK1MKNK2CHEK2 | |
| SCHEMBL28103664 | 0.78 | CA2 (0.46) | CYP17A1CYP2D6 | |
| SCHEMBL6299308 | 0.78 | ALDH1A1 (0.53) | CYP2D6ROCK1MAPK1ROCK2CYP3A4 | |
| SCHEMBL3104632 | 0.77 | CYP17A1 (0.72) | MAP4K4CYP17A1MKNK1MKNK2CHEK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2480235-A2 | NOVEL IODO PYRIMIDINE DERIVATIVES USEFUL FOR THE TREATMENT OF MACROPHAGE MIGRATION INHIBITORY FACTOR (MIF)-IMPLICATED DISEASES AND CONDITIONS | University Of Louisville Research Foundation, Inc. (US) | 2012-08-01 | — | — | EP | claimed |
| WO-2011038234-A2 | NOVEL IODO PYRIMIDINE DERIVATIVES USEFUL FOR THE TREATMENT OF MACROPHAGE MIGRATION INHIBITORY FACTOR (MIF)-IMPLICATED DISEASES AND CONDITIONS | UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) | 2011-03-31 | — | — | WO | claimed |
| EP-2193119-B1 | 4-(4-PYRIDINYL)-BENZAMIDES AND THEIR USE AS ROCK ACTIVITY MODULATORS | ABBVIE DEUTSCHLAND (DE) | 2014-01-01 | — | — | EP | disclosed |
| EP-2193119-A1 | 4-(4-PYRIDINYL)-BENZAMIDES AND THEIR USE AS ROCK ACTIVITY MODULATORS | Abbott GmbH & Co. KG (DE) | 2010-06-09 | — | — | EP | disclosed |
| WO-2009027392-A1 | 4-(4-PYRIDINYL)-BENZAMIDES AND THEIR USE AS ROCK ACTIVITY MODULATORS | ABBOTT GMBH & CO. KG (DE) | 2009-03-05 | — | — | WO | disclosed |