Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
| ▸ | HAT1 | O14929 | 1/20 | 0.31 |
| ▸ | EP300 | Q09472 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6668749 | 0.90 | NR1H4 (0.36) | NR1H4NPC1HSP90AA1PIN1P2RX7 | |
| SCHEMBL6672672 | 0.88 | NR1H4 (0.34) | NR1H4NPC1HSP90AA1P2RX7 | |
| SCHEMBL6672237 | 0.86 | NR1H4 (0.33) | NR1H4HSP90AA1P2RX7 | |
| SCHEMBL6666111 | 0.83 | NR1H4 (0.37) | NR1H4NPC1HSP90AA1PIN1P2RX7 | |
| SCHEMBL6667531 | 0.79 | NR1H4 (0.34) | NR1H4NPC1HSP90AA1P2RX7 | |
| SCHEMBL6672234 | 0.78 | NR1H4 (0.34) | NR1H4NPC1HSP90AA1P2RX7 | |
| SCHEMBL7482403 | 0.78 | NR1H4 (0.34) | NR1H4NPC1HSP90AA1P2RX7 | |
| SCHEMBL7472513 | 0.76 | AKR1C3 (0.36) | NR1H4NPC1 | |
| SCHEMBL6668075 | 0.75 | ABCB1 (0.38) | ALDH1A1 | |
| SCHEMBL6668752 | 0.74 | RAB9A (0.44) | HAT1EP300NPC1TP53KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1265873-A2 | 4-OXO-1,4-DIHYDRO-3-CINNOLINECARBOXAMIDES AS ANTIVIRAL AGENTS | PHARMACIA & UPJOHN COMPANY (US) | 2002-12-18 | — | — | EP | disclosed |
| WO-2001070706-A2 | 4-OXO-1,4-DIHYDRO-3-CINNOLINECARBOXAMIDES AS ANTIVIRAL AGENTS | PHARMACIA & UPJOHN COMPANY (US) | 2001-09-27 | — | — | WO | disclosed |