Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.43 |
| ▸ | TDP2 | O95551 | 2/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.42 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.41 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.38 |
| ▸ | CHRNG | P07510 | 1/20 | 0.38 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.38 |
| ▸ | CHRND | Q07001 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | APAF1 | O14727 | 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 | |
|---|---|---|---|---|
| SCHEMBL2598013 | 1.00 | CHEK1 (0.43) | CHEK1HRH3TDP2PARP10PARP11 | |
| SCHEMBL1804449 | 1.00 | CHEK1 (0.43) | CHEK1HRH3TDP2PARP10PARP11 | |
| SCHEMBL1804451 | 1.00 | CHEK1 (0.43) | CHEK1HRH3TDP2PARP10PARP11 | |
| SCHEMBL2598088 | 0.84 | HRH3 (0.52) | CHEK1HRH3TDP2PARP10PARP11 | |
| SCHEMBL861530 | 0.84 | HRH3 (0.52) | CHEK1HRH3TDP2PARP10PARP11 | |
| SCHEMBL861531 | 0.84 | HRH3 (0.52) | CHEK1HRH3TDP2PARP10PARP11 | |
| SCHEMBL14889351 | 0.82 | PARP10 (0.52) | CHEK1HRH3TDP2PARP10PARP11 | |
| SCHEMBL2598099 | 0.82 | PARP10 (0.52) | CHEK1HRH3TDP2PARP10PARP11 | |
| SCHEMBL2598100 | 0.82 | PARP10 (0.52) | CHEK1HRH3TDP2PARP10PARP11 | |
| SCHEMBL14889350 | 0.82 | PARP10 (0.52) | CHEK1HRH3TDP2PARP10PARP11 |
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-2571353-A1 | MODULATORS OF 5-HT RECEPTORS AND METHODS OF USE THEREOF | AbbVie Inc. (US) | 2013-03-27 | — | — | EP | claimed |
| WO-2011146089-A1 | MODULATORS OF 5-HT RECEPTORS AND METHODS OF USE THEREOF | ABBOTT LABORATORIES (US) | 2011-11-24 | — | — | WO | claimed |