Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 17/20 | 0.53 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.49 |
| ▸ | CPT2 | P23786 | 1/20 | 0.44 |
| ▸ | CPT1A | P50416 | 1/20 | 0.44 |
| ▸ | F10 | P00742 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16624117 | 0.84 | ACACB (0.51) | ACACBABHD6 | |
| SCHEMBL17965644 | 0.82 | ALDH1A1 (0.40) | ACACBABHD6 | |
| SCHEMBL17965640 | 0.82 | ACACB (0.42) | ACACB | |
| SCHEMBL17607339 | 0.82 | GRIN1 (0.48) | — | |
| SCHEMBL17993878 | 0.81 | ACACB (0.53) | ACACB | |
| SCHEMBL17585135 | 0.80 | ACACB (0.52) | ACACBABHD6 | |
| SCHEMBL23774090 | 0.78 | ACACB (0.51) | ACACBABHD6 | |
| SCHEMBL16624097 | 0.78 | ACACB (0.56) | ACACB | |
| SCHEMBL17607351 | 0.77 | ACACB (0.52) | ACACBABHD6CPT2CPT1AF10 | |
| SCHEMBL17607369 | 0.74 | ESR2 (0.41) | ABHD6 |
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-3194367-A1 | TETRAHYDROISOQUINOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR THE TREATMENT OF OBESITY AND DIABETES | Boehringer Ingelheim International GmbH (DE) | 2017-07-26 | — | — | EP | disclosed |
| WO-2016041845-A1 | TETRAHYDROISOQUINOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR THE TREATMENT OF OBESITY AND DIABETES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2016-03-24 | — | — | WO | disclosed |