Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | F10 | P00742 | 3/20 | 0.34 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.33 |
| ▸ | LCAT | P04180 | 1/20 | 0.33 |
| ▸ | UGCG | Q16739 | 1/20 | 0.33 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.33 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.33 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.33 |
| ▸ | ITGAL | P20701 | 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 | |
|---|---|---|---|---|
| SCHEMBL4720971 | 1.00 | ABL1 (0.41) | ABL1P2RX7CYP11B1CYP11B2PDE4A | |
| SCHEMBL4719498 | 0.92 | P2RX7 (0.38) | P2RX7PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4724695 | 0.92 | P2RX7 (0.38) | P2RX7PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4719501 | 0.92 | P2RX7 (0.38) | P2RX7PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4720188 | 0.91 | PTGS2 (0.40) | P2RX7PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4720190 | 0.91 | PTGS2 (0.40) | P2RX7PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4724096 | 0.90 | P2RX7 (0.40) | P2RX7PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4724086 | 0.90 | P2RX7 (0.40) | P2RX7PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4722958 | 0.89 | P2RX7 (0.38) | P2RX7PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4718757 | 0.89 | ROCK2 (0.37) | P2RX7PDE4APDE4BPDE4CPDE4D |
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-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |