Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPS1 | P31327 | 5/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.44 |
| ▸ | MTOR | P42345 | 2/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13503925 | 0.85 | MAPT (0.48) | HTTLMNAMAPTTSHRALDH1A1 | |
| SCHEMBL13503932 | 0.85 | HTT (0.50) | HTTLMNAMAPTTSHRKDM4E | |
| SCHEMBL17400771 | 0.84 | CPS1 (0.52) | CPS1HTTTSHRKDM4ECHRNA7 | |
| SCHEMBL7872416 | 0.84 | CPS1 (0.57) | CPS1HTTLMNAMAPTTSHR | |
| SCHEMBL18010744 | 0.84 | CPS1 (0.57) | CPS1HTTLMNAMAPTTSHR | |
| SCHEMBL7878686 | 0.83 | CPS1 (0.60) | CPS1HTTLMNAMAPTTSHR | |
| SCHEMBL12205464 | 0.82 | CPS1 (0.58) | CPS1HTTLMNAMAPTTSHR | |
| SCHEMBL13504079 | 0.81 | TSHR (0.63) | HTTLMNAMAPTTSHRKDM4E | |
| SCHEMBL12237788 | 0.81 | HTT (0.52) | HTTLMNAMAPTTSHRKDM4E | |
| SCHEMBL7878481 | 0.80 | ALDH1A1 (0.55) | CPS1HTTLMNAMAPTTSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010122069-A1 | 5-ALKYNYL-PYRIDINES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-10-28 | — | — | WO | disclosed |