Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | PIM1 | P11309 | 4/20 | 0.42 |
| ▸ | PIM3 | Q86V86 | 4/20 | 0.42 |
| ▸ | PIM2 | Q9P1W9 | 4/20 | 0.42 |
| ▸ | KDM4C | Q9H3R0 | 6/20 | 0.42 |
| ▸ | KDM6B | O15054 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | KDM4A | O75164 | 1/20 | 0.42 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.42 |
| ▸ | GPBAR1 | Q8TDU6 | 6/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.40 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.39 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27944390 | 0.86 | MEN1 (0.48) | GSK3AGSK3BPIM1PIM3PIM2 | |
| SCHEMBL12097337 | 0.85 | LMNA (0.50) | GSK3AGSK3BPIM1PIM3PIM2 | |
| SCHEMBL16628646 | 0.78 | GPBAR1 (0.48) | GSK3AGSK3BPIM3PIM2KDM4C | |
| SCHEMBL12097392 | 0.77 | GPBAR1 (0.47) | GSK3AGSK3BPIM1PIM3PIM2 | |
| SCHEMBL12097353 | 0.77 | GPBAR1 (0.41) | GSK3AGSK3BPIM1PIM3PIM2 | |
| Hydrochloric Acid SCHEMBL27958789 | 0.76 | AOC1 (0.44) | GSK3AGSK3BPIM1PIM3PIM2 | |
| SCHEMBL2000076 | 0.76 | GSK3B (0.44) | GSK3AGSK3BPIM1PIM3PIM2 | |
| SCHEMBL18857778 | 0.75 | KDM4C (0.46) | KDM4CKDM6BKDM4EKDM4AKDM4D | |
| SCHEMBL12097766 | 0.75 | GPBAR1 (0.45) | GSK3AGSK3BPIM1PIM3PIM2 | |
| SCHEMBL27958536 | 0.74 | GSK3A (0.44) | GSK3AGSK3BPIM1PIM3PIM2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2681194-B1 | 3-AMINO-PYRIDINES AS GPBAR1 AGONISTS | HOFFMANN LA ROCHE (CH) | 2015-04-15 | — | — | EP | disclosed |