Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 19/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | SMO | Q99835 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2185145 | 0.88 | CCR1 (0.58) | CCR1CYP3A4KCNH2ADRB1SMO | |
| SCHEMBL2184138 | 0.86 | CCR1 (0.56) | CCR1CYP3A4KCNH2ADRB1SMO | |
| SCHEMBL2185205 | 0.86 | CCR1 (0.62) | CCR1CYP3A4KCNH2ADRB1 | |
| SCHEMBL2185639 | 0.86 | CCR1 (0.60) | CCR1CYP3A4KCNH2ADRB1 | |
| SCHEMBL2184692 | 0.82 | CCR1 (0.48) | CCR1CYP3A4KCNH2ADRB1 | |
| SCHEMBL2184729 | 0.82 | CCR1 (0.52) | CCR1CYP3A4KCNH2ADRB1 | |
| SCHEMBL2185409 | 0.82 | CCR1 (0.53) | CCR1CYP3A4KCNH2ADRB1 | |
| SCHEMBL2183720 | 0.82 | CCR1 (0.53) | CCR1CYP3A4KCNH2ADRB1 | |
| SCHEMBL2185476 | 0.79 | CCR1 (0.54) | CCR1CYP3A4KCNH2ADRB1 | |
| SCHEMBL2182254 | 0.78 | CCR1 (0.48) | CCR1CYP3A4KCNH2ADRB1 |
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-2346868-A1 | AZAINDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-07-27 | — | — | EP | disclosed |