Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | VEGFA | P15692 | 1/20 | 0.37 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.37 |
| ▸ | MBTPS1 | Q14703 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | SPHK2 | Q9NRA0 | 2/20 | 0.34 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.34 |
| ▸ | MCHR2 | Q969V1 | 1/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.34 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.34 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13634788 | 0.94 | S1PR1 (0.48) | S1PR1HDAC8HDAC6HDAC1VEGFA | |
| SCHEMBL13638928 | 0.92 | S1PR1 (0.48) | S1PR1HDAC8HDAC6HDAC1VEGFA | |
| SCHEMBL13638884 | 0.92 | S1PR1 (0.47) | S1PR1HDAC8HDAC6HDAC1VEGFA | |
| SCHEMBL13270723 | 0.92 | S1PR1 (0.42) | S1PR1HDAC8HDAC6HDAC1VEGFA | |
| SCHEMBL13634595 | 0.91 | S1PR1 (0.49) | S1PR1HDAC8HDAC6HDAC1MBTPS1 | |
| SCHEMBL13634893 | 0.86 | ADORA2A (0.38) | S1PR1CHEK1MAP4K1 | |
| SCHEMBL13162957 | 0.85 | S1PR1 (0.42) | S1PR1HDAC8HDAC6HDAC1MBTPS1 | |
| SCHEMBL13638887 | 0.82 | S1PR1 (0.47) | S1PR1HDAC8HDAC6HDAC1SIGMAR1 | |
| SCHEMBL13270438 | 0.80 | ADORA2A (0.38) | S1PR1MAP4K1 | |
| SCHEMBL13634841 | 0.80 | S1PR1 (0.49) | S1PR1HDAC8HDAC6HDAC1SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8304547-B2 | Azolecarboxamide compound or salt thereof | ASTELLAS PHARMA INC. (JP) | 2012-11-06 | — | — | US | disclosed |
| US-8304547-B2 | Azolecarboxamide compound or salt thereof | ASTELLAS PHARMA INC. (JP) | 2012-11-06 | — | — | US | disclosed |