Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.47 |
| ▸ | TMPRSS15 | P98073 | 9/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | AGTR1 | P30556 | 3/20 | 0.34 |
| ▸ | AGTR2 | P50052 | 3/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HCAR3 | P49019 | 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 | |
|---|---|---|---|---|
| SCHEMBL24853458 | 0.79 | HCAR2 (0.57) | HCAR2TMPRSS15KDM4EALDH1A1AGTR1 | |
| SCHEMBL25410152 | 0.75 | TMPRSS15 (0.59) | HCAR2TMPRSS15 | |
| SCHEMBL2435872 | 0.75 | ALDH1A1 (0.46) | HCAR2TMPRSS15KDM4EALDH1A1AGTR1 | |
| SCHEMBL17607365 | 0.74 | HCAR2 (0.47) | HCAR2TMPRSS15KDM4EALDH1A1AGTR1 | |
| SCHEMBL15530378 | 0.74 | KDM4E (0.48) | HCAR2TMPRSS15KDM4EALDH1A1AGTR1 | |
| SCHEMBL25408977 | 0.74 | TMPRSS15 (0.60) | HCAR2TMPRSS15ALDH1A1 | |
| SCHEMBL25410683 | 0.73 | TMPRSS15 (0.61) | HCAR2TMPRSS15ALDH1A1 | |
| SCHEMBL31482107 | 0.73 | MLYCD (0.44) | HCAR2TMPRSS15KDM4EALDH1A1AGTR1 | |
| SCHEMBL6496980 | 0.68 | HCAR2 (0.44) | HCAR2TMPRSS15KDM4EALDH1A1AGTR1 | |
| SCHEMBL8198536 | 0.68 | TMPRSS15 (0.42) | TMPRSS15KDM4EALDH1A1HSD17B10 |
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 |