Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 12/20 | 0.54 |
| ▸ | FABP6 | P51161 | 1/20 | 0.43 |
| ▸ | PARP10 | Q53GL7 | 4/20 | 0.40 |
| ▸ | PARP11 | Q9NR21 | 4/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.38 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.38 |
| ▸ | LTK | P29376 | 1/20 | 0.33 |
| ▸ | MST1R | Q04912 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21333792 | 0.80 | FABP6 (0.50) | PARP1FABP6PARP10PARP11PDPK1 | |
| SCHEMBL21999476 | 0.80 | PARP1 (0.54) | PARP1FABP6PARP10PARP11PDPK1 | |
| SCHEMBL2985573 | 0.80 | PARP1 (0.54) | PARP1FABP6PARP10PARP11PDPK1 | |
| SCHEMBL2983974 | 0.76 | ALPL (0.46) | PARP1FABP6PARP10PARP11 | |
| SCHEMBL1027825 | 0.75 | DRD2 (0.39) | PARP1 | |
| SCHEMBL21461173 | 0.75 | S100A4 (0.42) | PARP1FABP6PARP10PARP11PDPK1 | |
| SCHEMBL2085452 | 0.75 | PARP1 (0.44) | PARP1FABP6PARP10PARP11PDPK1 | |
| SCHEMBL2060616 | 0.74 | FABP6 (0.55) | PARP1FABP6PARP10PARP11 | |
| SCHEMBL3993011 | 0.74 | LMNA (0.44) | PARP1 | |
| SCHEMBL12714478 | 0.73 | FABP6 (0.43) | PARP1FABP6CDK5CLK4CSNK1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3227263-B1 | CXCR7 RECEPTOR MODULATORS | IDORSIA PHARMACEUTICALS LTD (CH) | 2019-04-10 | — | — | EP | disclosed |