Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 5/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | GLS | O94925 | 1/20 | 0.35 |
| ▸ | SCD | O00767 | 2/20 | 0.35 |
| ▸ | SCD5 | Q86SK9 | 2/20 | 0.35 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | TNK1 | Q13470 | 1/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 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 | |
|---|---|---|---|---|
| SCHEMBL13634656 | 1.00 | DRD4 (0.41) | DRD4GRM2KCNH2GLSSCD | |
| SCHEMBL2770243 | 0.95 | KMT2A (0.38) | DRD4GRM2KCNH2SCDSCD5 | |
| SCHEMBL13639001 | 0.95 | KMT2A (0.38) | DRD4GRM2KCNH2SCDSCD5 | |
| SCHEMBL13162737 | 0.94 | GRM2 (0.36) | DRD4GRM2KCNH2SCDSCD5 | |
| SCHEMBL13634725 | 0.93 | DRD4 (0.46) | DRD4GRM2KCNH2GLSSCD | |
| SCHEMBL13634887 | 0.92 | GLS (0.36) | DRD4GLSSCDSCD5PARP1 | |
| SCHEMBL13634884 | 0.92 | S1PR1 (0.40) | DRD4MEN1ALDH1A1CYP1A2CYP3A4 | |
| Fumaric Acid SCHEMBL2771640 | 0.91 | CCKAR (0.36) | DRD4GRM2KCNH2SCDSCD5 | |
| Fumaric Acid SCHEMBL2771644 | 0.91 | CCKAR (0.36) | DRD4GRM2KCNH2SCDSCD5 | |
| SCHEMBL13164112 | 0.91 | GRM2 (0.37) | GRM2KCNH2SCDSCD5HCAR1 |
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 |