Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | LPL | P06858 | 1/20 | 0.31 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.31 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.31 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.31 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.31 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL144194 | 0.84 | HCAR2 (0.43) | HCAR2ATMCYP2A6CA2LPL | |
| SCHEMBL30941538 | 0.84 | HCAR2 (0.43) | HCAR2ATMCYP2A6CA2LPL | |
| SCHEMBL18417966 | 0.81 | HCAR2 (0.40) | HCAR2ATMCYP2A6 | |
| SCHEMBL5339278 | 0.80 | HCAR2 (0.41) | HCAR2ATMCYP2A6CA2LPL | |
| SCHEMBL15474175 | 0.77 | HCAR2 (0.42) | HCAR2ORAI1ORAI2ORAI3TRPV6 | |
| SCHEMBL28203596 | 0.75 | ATM (0.38) | HCAR2ATMCYP2A6 | |
| SCHEMBL12666686 | 0.72 | CYP11B1 (0.33) | — | |
| SCHEMBL12270851 | 0.72 | ALDH1A1 (0.43) | CA2LPLLIPGORAI1ORAI2 | |
| SCHEMBL8931090 | 0.71 | HCAR2 (0.36) | HCAR2ATMCYP2A6 | |
| SCHEMBL24225 | 0.71 | — | — |
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-2493875-B1 | HETEROCYCLIC COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INT (DE) | 2014-08-06 | — | — | EP | disclosed |