Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 2/20 | 0.34 |
| ▸ | MMP12 | P39900 | 2/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | TACR1 | P25103 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CCR3 | P51677 | 1/20 | 0.33 |
| ▸ | GPR6 | P46095 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.32 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3254884 | 0.91 | SIGMAR1 (0.35) | SIGMAR1TACR1TP53GPR6RIPK1 | |
| SCHEMBL3256637 | 0.89 | TACR1 (0.35) | TACR1TP53MEN1KMT2AP2RX7 | |
| SCHEMBL3255401 | 0.89 | P2RX7 (0.39) | TP53MEN1KMT2AP2RX7GAA | |
| SCHEMBL3255755 | 0.87 | ALDH1A1 (0.36) | TP53MEN1KMT2AROCK2ROCK1 | |
| SCHEMBL3255413 | 0.86 | ALDH1A1 (0.38) | TP53MAPTP2RX7 | |
| SCHEMBL3254057 | 0.85 | TP53 (0.42) | TP53MEN1KMT2AMAPTP2RX7 | |
| SCHEMBL3255000 | 0.84 | P2RX7 (0.43) | SIGMAR1TP53P2RX7 | |
| SCHEMBL3253367 | 0.84 | KDM1A (0.35) | SIGMAR1TP53HTTGAAKDM1A | |
| SCHEMBL3258335 | 0.83 | ALDH1A1 (0.38) | MAPTP2RX7 | |
| SCHEMBL3256647 | 0.83 | P2RX7 (0.34) | TP53RIPK1P2RX7GAA |
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-1651613-B1 | 4,5-DIHYDRO-IMIDAZOLE AS P2X7 ION CHANNEL BLOCKERS | AVENTIS PHARMA INC (US) | 2010-05-26 | — | — | EP | disclosed |