Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.44 |
| ▸ | FNTA | P49354 | 1/20 | 0.40 |
| ▸ | FNTB | P49356 | 1/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 8/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL19190527 | 1.00 | RIPK1 (0.44) | RIPK1FNTAFNTBP2RX7OPRL1 | |
| SCHEMBL14853258 | 0.86 | PDE4D (0.46) | RIPK1P2RX7PDE4APDE4BPDE4C | |
| SCHEMBL23853811 | 0.83 | HTR1A (0.40) | RIPK1P2RX7OPRL1L3MBTL1 | |
| SCHEMBL2539878 | 0.81 | RIPK1 (0.41) | RIPK1P2RX7TP53 | |
| SCHEMBL27820352 | 0.81 | HRH3 (0.41) | RIPK1P2RX7L3MBTL1 | |
| SCHEMBL2539880 | 0.81 | RIPK1 (0.41) | RIPK1P2RX7TP53 | |
| SCHEMBL2546555 | 0.81 | CYP2C19 (0.49) | TP53L3MBTL1 | |
| SCHEMBL2546557 | 0.81 | CYP2C19 (0.49) | TP53L3MBTL1 | |
| SCHEMBL14853464 | 0.81 | P2RX7 (0.42) | RIPK1P2RX7 | |
| SCHEMBL16803040 | 0.80 | ABL1 (0.43) | RIPK1P2RX7OPRL1L3MBTL1 |
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-2763997-B1 | CYCLOHEXYL-4H,6H-5-OXA-2,3,10B-TRIAZA-BENZO[E]AZULENES AS V1A ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2017-08-02 | — | — | EP | disclosed |