Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CHKA | P35790 | 1/20 | 0.42 |
| ▸ | ACACB | O00763 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | LCAT | P04180 | 2/20 | 0.38 |
| ▸ | DPP4 | P27487 | 5/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 7/20 | 0.35 |
| ▸ | PSEN2 | P49810 | 7/20 | 0.35 |
| ▸ | APH1B | Q8WW43 | 7/20 | 0.35 |
| ▸ | NCSTN | Q92542 | 7/20 | 0.35 |
| ▸ | APH1A | Q96BI3 | 7/20 | 0.35 |
| ▸ | PSENEN | Q9NZ42 | 7/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.33 |
| ▸ | TAF1 | P21675 | 1/20 | 0.33 |
| ▸ | CECR2 | Q9BXF3 | 1/20 | 0.33 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.33 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18952546 | 1.00 | CA2 (0.42) | CA2CHKAACACBPARP1LCAT | |
| SCHEMBL21726855 | 1.00 | CA2 (0.42) | CA2CHKAACACBPARP1LCAT | |
| SCHEMBL21726853 | 1.00 | CA2 (0.42) | CA2CHKAACACBPARP1LCAT | |
| SCHEMBL21726804 | 0.81 | DPP4 (0.36) | DPP4PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL18952597 | 0.81 | DPP4 (0.36) | DPP4PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL18952596 | 0.81 | DPP4 (0.36) | DPP4PSEN1PSEN2APH1BNCSTN | |
| Hydrochloric Acid SCHEMBL2273587 | 0.79 | KDR (0.45) | CA2CHKAACACBPARP1LCAT | |
| SCHEMBL20609175 | 0.78 | PSEN1 (0.42) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL18971472 | 0.78 | PSEN1 (0.39) | DPP4PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL20609161 | 0.78 | PSEN1 (0.39) | DPP4PSEN1PSEN2APH1BNCSTN |
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-3386978-B1 | BRIDGED PIPERIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2021-01-27 | — | — | EP | disclosed |
| WO-2017097728-A1 | BRIDGED PIPERIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2017-06-15 | — | — | WO | disclosed |