Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | GLS | O94925 | 1/20 | 0.35 |
| ▸ | SCD | O00767 | 2/20 | 0.35 |
| ▸ | SCD5 | Q86SK9 | 2/20 | 0.35 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | TNK1 | Q13470 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.33 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13638916 | 0.95 | HDAC8 (0.43) | S1PR1HDAC8HDAC6HDAC1DRD2 | |
| SCHEMBL13634557 | 0.93 | S1PR1 (0.42) | S1PR1HDAC8HDAC6HDAC1DRD2 | |
| SCHEMBL13634855 | 0.90 | S1PR1 (0.36) | S1PR1HDAC8HDAC6HDAC1GLS | |
| SCHEMBL13634565 | 0.89 | GRM2 (0.35) | S1PR1DRD2GLSSCDSCD5 | |
| SCHEMBL13634906 | 0.88 | SCD (0.38) | S1PR1GLSSCDSCD5PARP1 | |
| SCHEMBL13634760 | 0.88 | GLS (0.40) | DRD2GLSSCDSCD5PIN1 | |
| SCHEMBL13634564 | 0.87 | SCD (0.35) | S1PR1GLSSCDSCD5 | |
| SCHEMBL13634566 | 0.87 | SCD (0.35) | S1PR1GLSSCDSCD5 | |
| SCHEMBL13634771 | 0.87 | S1PR1 (0.49) | S1PR1HDAC8HDAC6HDAC1DRD2 | |
| SCHEMBL13634751 | 0.87 | GLS (0.39) | DRD2GLSSCDSCD5PARP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8304547-B2 | Azolecarboxamide compound or salt thereof | ASTELLAS PHARMA INC. (JP) | 2012-11-06 | — | — | US | disclosed |