Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 9/20 | 0.33 |
| ▸ | LOX | P28300 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24670388 | 0.69 | CA2 (0.50) | CA2 | |
| SCHEMBL24670395 | 0.69 | CA2 (0.42) | CA2 | |
| SCHEMBL6798039 | 0.67 | CA2 (0.52) | HTR6CA2TSHR | |
| SCHEMBL28342951 | 0.66 | DAO (0.44) | TSHR | |
| SCHEMBL25689016 | 0.66 | HTR2A (0.46) | — | |
| SCHEMBL2180225 | 0.65 | CES2 (0.38) | CA2 | |
| SCHEMBL15880882 | 0.64 | CA2 (0.39) | CA2 | |
| Hydrochloric Acid SCHEMBL1871819 | 0.63 | CYP2A6 (0.41) | CA2TSHR | |
| SCHEMBL5215479 | 0.63 | ENPP2 (0.38) | CA2 | |
| SCHEMBL25689015 | 0.63 | LTB4R (0.38) | — |
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-2346868-A1 | AZAINDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-07-27 | — | — | EP | disclosed |
| WO-2010036632-A1 | AZAINDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-04-01 | — | — | WO | disclosed |