Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 1/20 | 0.49 |
| ▸ | CTSC | P53634 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ESRRA | P11474 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RXRA | P19793 | 4/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.41 |
| ▸ | MIF | P14174 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14701729 | 0.78 | CA1 (0.56) | KMT2ANPC1RAB9ASMN1; SMN2ESRRA | |
| SCHEMBL20263181 | 0.77 | KMT2A (0.50) | KMT2ANPC1RAB9ASMN1; SMN2ESRRA | |
| SCHEMBL22643110 | 0.75 | CA9 (0.51) | CTSKCTSCCA12CA1CA2 | |
| SCHEMBL22642979 | 0.75 | NOTUM (0.60) | CTSKCTSCRXRAGRIN1GRIN2B | |
| SCHEMBL22643118 | 0.74 | P2RX7 (0.60) | CTSKCTSCRXRAGRIN1GRIN2B | |
| SCHEMBL22643113 | 0.74 | CTSK (0.54) | CTSKCTSCALDH1A1RXRAGRIN1 | |
| SCHEMBL22643248 | 0.72 | CTSK (0.55) | CTSKCTSCKMT2ANPC1ALDH1A1 | |
| SCHEMBL23889183 | 0.71 | ESRRA (0.59) | NPC1ESRRACA1CA2CA9 | |
| SCHEMBL30412575 | 0.71 | SIGMAR1 (0.39) | KMT2ARXRAGRIN1GRIN2B | |
| SCHEMBL24215708 | 0.71 | SIGMAR1 (0.39) | KMT2ARXRAGRIN1GRIN2B |
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 |