Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.47 |
| ▸ | PRKCZ | Q05513 | 2/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.39 |
| ▸ | CCR2 | P41597 | 2/20 | 0.38 |
| ▸ | CCR4 | P51679 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.37 |
| ▸ | PRKCG | P05129 | 1/20 | 0.37 |
| ▸ | PRKCB | P05771 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | PRKCA | P17252 | 1/20 | 0.37 |
| ▸ | PRKACA | P17612 | 1/20 | 0.37 |
| ▸ | PRKACG | P22612 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3226880 | 0.93 | PDE4B (0.52) | CYP1A2CYP3A4CYP2C19LMNAPDE4B | |
| SCHEMBL3220136 | 0.75 | PDE4B (0.45) | LMNAPDE4BPRKCZROCK2ROCK1 | |
| SCHEMBL116945 | 0.71 | CYP3A4 (1.00) | CYP1A2CYP3A4CYP2C19LMNACYP2D6 | |
| SCHEMBL30692015 | 0.71 | CYP3A4 (1.00) | CYP1A2CYP3A4CYP2C19LMNACYP2D6 | |
| SCHEMBL4566834 | 0.70 | PDE4B (0.44) | CYP1A2CYP3A4CYP2C19PDE4BPRKCZ | |
| Iodide SCHEMBL11812745 | 0.70 | CYP3A4 (0.96) | CYP1A2CYP3A4CYP2C19LMNACYP2D6 | |
| Hydrochloric Acid SCHEMBL1000639 | 0.70 | CYP3A4 (0.96) | CYP1A2CYP3A4CYP2C19LMNACYP2D6 | |
| SCHEMBL3224634 | 0.68 | ROCK2 (0.44) | PDE4BROCK2ROCK1KDM4EALDH1A1 | |
| SCHEMBL7352314 | 0.68 | LMNA (0.49) | CYP1A2CYP3A4CYP2C19LMNACYP2D6 | |
| SCHEMBL9746696 | 0.66 | CYP3A4 (0.72) | CYP1A2CYP3A4CYP2C19LMNACYP2D6 |
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-2120933-A1 | ISOQUINOLINOPYRROLOPYRIDINONES ACTIVE AS KINASE INHIBITORS | Nerviano Medical Sciences S.r.l. (IT) | 2009-11-25 | — | — | EP | disclosed |
| WO-2008104475-A1 | ISOQUINOLINOPYRROLOPYRIDINONES ACTIVE AS KINASE INHIBITORS | NERVIANO MEDICAL SCIENCES S.R.L. (IT) | 2008-09-04 | — | — | WO | disclosed |