Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 6/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.41 |
| ▸ | CCR4 | P51679 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 9/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.38 |
| ▸ | PRKCG | P05129 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | PRKCB | P05771 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | PRKCA | P17252 | 1/20 | 0.38 |
| ▸ | PRKACA | P17612 | 1/20 | 0.38 |
| ▸ | PRKACG | P22612 | 1/20 | 0.38 |
| ▸ | PRKACB | P22694 | 1/20 | 0.38 |
| ▸ | PRKCH | P24723 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PRKCI | P41743 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3220136 | 0.77 | PDE4B (0.45) | PDE4BROCK2ROCK1CCR4P2RX7 | |
| SCHEMBL3226880 | 0.76 | PDE4B (0.52) | PDE4BROCK2ROCK1CCR4P2RX7 | |
| SCHEMBL4566836 | 0.70 | CYP1A2 (0.51) | PDE4BROCK2ROCK1CCR4P2RX7 | |
| SCHEMBL25175478 | 0.66 | ADRA2A (0.70) | ROCK2ROCK1CCR4TRPV1KDM4E | |
| SCHEMBL28198748 | 0.65 | ROCK2 (0.43) | ROCK2ROCK1TRPV1PRKCZCCR2 | |
| SCHEMBL7352314 | 0.64 | LMNA (0.49) | PDE4BROCK2ROCK1CCR4P2RX7 | |
| SCHEMBL7355127 | 0.64 | CCR4 (0.48) | PDE4BROCK2ROCK1CCR4P2RX7 | |
| SCHEMBL1716884 | 0.64 | ROCK2 (0.72) | ROCK2ROCK1PRKCZCCR2 | |
| SCHEMBL30544195 | 0.63 | KDM4E (0.67) | ROCK1TRPV1KDM4E | |
| SCHEMBL2315592 | 0.63 | KDM4E (0.67) | ROCK1TRPV1KDM4E |
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 |