Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 2/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | BRAF | P15056 | 1/20 | 0.36 |
| ▸ | EIF2AK4 | Q9P2K8 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.32 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.32 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22642860 | 0.84 | CTSC (0.47) | CTSCDGAT1CHRM2KCNH2SLC6A4 | |
| SCHEMBL20180729 | 0.80 | DGAT1 (0.41) | DGAT1CHRM2KCNH2SLC6A2SLC6A4 | |
| SCHEMBL21259130 | 0.74 | RXRA (0.41) | DGAT1KCNH2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL18436857 | 0.71 | MAPT (0.45) | DGAT1MAPT | |
| SCHEMBL19012618 | 0.71 | MAPT (0.45) | DGAT1MAPT | |
| SCHEMBL13849417 | 0.68 | DPP4 (0.40) | CTSCKCNH2MAPT | |
| SCHEMBL13849418 | 0.68 | DPP4 (0.40) | CTSCKCNH2MAPT | |
| SCHEMBL16088325 | 0.68 | PDE4B (0.36) | DGAT1CHRM2KCNH2SLC6A2SLC6A4 | |
| SCHEMBL7874316 | 0.67 | CPS1 (0.62) | — | |
| SCHEMBL23019662 | 0.67 | USP30 (0.50) | — |
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-2970283-B1 | SUBSTITUTED 2-AZA-BICYCLO[2.2.1]HEPTANE-3-CARBOXYLIC ACID (BENZYL-CYANO-METHYL)-AMIDES INHIBITORS OF CATHEPSIN C | BOEHRINGER INGELHEIM INT (DE) | 2020-11-11 | — | — | EP | disclosed |