Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CDK1 | P06493 | 6/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | CLK1 | P49759 | 1/20 | 0.38 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.38 |
| ▸ | CCNC | P24863 | 1/20 | 0.38 |
| ▸ | CDK8 | P49336 | 1/20 | 0.38 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.38 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.38 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.37 |
| ▸ | MAPK10 | P53779 | 3/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | F9 | P00740 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | RHEB | Q15382 | 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 | |
|---|---|---|---|---|
| SCHEMBL4844553 | 0.88 | GAA (0.42) | CDK1HTTNR2F2HDAC1HDAC8 | |
| SCHEMBL4148481 | 0.84 | CDK1 (0.43) | CDK1MAPK8MAPK10HRH4 | |
| SCHEMBL4150594 | 0.82 | CLK1 (0.38) | LMNACDK1CLK1HRH4CNR1 | |
| SCHEMBL4839125 | 0.77 | LMNA (0.40) | LMNACLK1HRH4 | |
| SCHEMBL4841553 | 0.76 | CNR1 (0.36) | CDK1HDAC1HDAC8HDAC6MAPK8 | |
| SCHEMBL4150728 | 0.76 | KDM4E (0.40) | LMNAHTTHDAC1HDAC8HDAC6 | |
| SCHEMBL4156270 | 0.75 | HRH4 (0.36) | LMNACDK1MAPK8MAPK10HRH4 | |
| SCHEMBL2995838 | 0.75 | HRH4 (0.40) | CDK1HRH4CNR1CNR2 | |
| SCHEMBL2995841 | 0.75 | HRH4 (0.40) | CDK1HRH4CNR1CNR2 | |
| SCHEMBL4841881 | 0.75 | HRH4 (0.35) | CDK1HDAC1HDAC8HDAC6HRH4 |
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 |
|---|---|---|---|---|---|---|---|
| US-7429597-B2 | Substituted nitrogen-containing heterobicycles, the preparation thereof and their use as pharmaceutical compositions | BOEHRINGER INGELHEIM PHARMA GMBH & CO., KG (DE) | 2008-09-30 | — | — | US | claimed |