Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDFT1 | P37268 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 3/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | EDNRA | P25101 | 1/20 | 0.31 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | SYK | P43405 | 1/20 | 0.30 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.30 |
| ▸ | PDE10A | Q9Y233 | 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 | |
|---|---|---|---|---|
| SCHEMBL18698969 | 0.78 | HDAC1 (0.43) | ARHDAC1HDAC8HDAC6BACE1 | |
| SCHEMBL16943126 | 0.77 | MAPT (0.43) | FDFT1HDAC1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28136433 | 0.76 | FDFT1 (0.44) | FDFT1SLC6A2SLC6A4SLC6A3CYP11B1 | |
| SCHEMBL25687977 | 0.76 | FDFT1 (0.45) | FDFT1SLC6A2SLC6A4SLC6A3CYP11B1 | |
| SCHEMBL23579386 | 0.76 | FDFT1 (0.41) | FDFT1SLC6A2SLC6A4SLC6A3CYP11B1 | |
| SCHEMBL1585755 | 0.75 | ADRA2A (0.49) | FDFT1SLC6A2SLC6A4SLC6A3CYP11B1 | |
| Hydrochloric Acid SCHEMBL1871520 | 0.74 | FDFT1 (0.44) | FDFT1SLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL25431317 | 0.74 | STK17A (0.40) | FDFT1P4HTM | |
| SCHEMBL26987994 | 0.74 | AGER (0.42) | ARL3MBTL1 | |
| Hydrochloric Acid SCHEMBL2714669 | 0.73 | ADRA2A (0.51) | FDFT1SLC6A2SLC6A4SLC6A3EDNRA |
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 |