Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.43 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11483014 | 0.84 | NQO1 (0.48) | NPSR1LMNAALDH1A1SCN9AHPGD | |
| SCHEMBL11239685 | 0.81 | PTGES (0.50) | GPR84NPSR1LMNAALDH1A1SCN9A | |
| SCHEMBL11468702 | 0.81 | TP53 (0.49) | NPSR1LMNAALDH1A1SCN9AHPGD | |
| SCHEMBL11244627 | 0.80 | ADK (0.38) | NPSR1TSHRALDH1A1SCN9AHPGD | |
| SCHEMBL28303870 | 0.79 | ADORA2A (0.52) | GPR84NPSR1ADORA2AADORA1LMNA | |
| SCHEMBL11268851 | 0.79 | SMN1; SMN2 (0.53) | GPR84NPSR1ADORA2AADORA1LMNA | |
| SCHEMBL31582507 | 0.79 | HTR7 (0.49) | NPSR1ADORA2AADORA1LMNATSHR | |
| SCHEMBL11469963 | 0.79 | GAA (0.48) | TSHRALDH1A1SCN9AHPGDSMN1; SMN2 | |
| SCHEMBL11471319 | 0.79 | MAPT (0.37) | NPSR1LMNATSHRALDH1A1SCN9A | |
| SCHEMBL11467215 | 0.78 | SCN9A (0.40) | NPSR1ADORA2AADORA1LMNAALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4310551-A | Pharmacologically active substituted 1,2,4-triazines | DIAMOND SHAMROCK CORPORATION (US) | 1982-01-12 | — | — | US | disclosed |
| US-4251527-A | ANTIINFLAMMATORY AGENTS | DIAMOND SHAMROCK CORPORATION (US) | 1981-02-17 | — | — | US | disclosed |
| US-4157392-A | HYPOTENSIVE AGENTS, ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS AND NERVOUS SYSTEM EFFECTS | DIAMOND SHAMROCK CORPORATION (US) | 1979-06-05 | — | — | US | disclosed |