Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1957909 | 0.92 | ALDH1A1 (0.53) | SMN1; SMN2LMNAMAPTALDH1A1HPGD | |
| SCHEMBL4457413 | 0.87 | — | — | |
| SCHEMBL8660213 | 0.87 | CASP1 (0.39) | SMN1; SMN2LMNAMAPTALDH1A1HPGD | |
| SCHEMBL8656235 | 0.87 | CASP1 (0.44) | SMN1; SMN2LMNAMAPTALDH1A1HPGD | |
| SCHEMBL8658631 | 0.85 | ALDH1A1 (0.39) | SMN1; SMN2LMNAMAPTALDH1A1HPGD | |
| SCHEMBL26111776 | 0.85 | ALDH1A1 (0.39) | SMN1; SMN2LMNAMAPTALDH1A1HPGD | |
| SCHEMBL26111987 | 0.85 | ALDH1A1 (0.39) | SMN1; SMN2LMNAMAPTALDH1A1HPGD | |
| SCHEMBL26109106 | 0.85 | ALDH1A1 (0.39) | SMN1; SMN2LMNAMAPTALDH1A1HPGD | |
| SCHEMBL26106560 | 0.85 | ALDH1A1 (0.39) | SMN1; SMN2LMNAMAPTALDH1A1HPGD | |
| SCHEMBL26109650 | 0.85 | ALDH1A1 (0.39) | SMN1; SMN2LMNAMAPTALDH1A1HPGD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102686589-B | Ethynyl derivatives | HOFFMANN LA ROCHE | 2014-12-10 | — | — | CN | disclosed |
| EP-0208281-B1 | QUINOLINE 8-CARBOXYLIC-ACID AZOLIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES | BASF Aktiengesellschaft (DE) | 1991-01-30 | — | — | EP | disclosed |
| US-4832731-A | Quinoline-8-carboxylic acid azolides and their use as herbicides | BASF AKTIENGESELLSCHAFT (DE) | 1989-05-23 | — | — | US | disclosed |
| EP-0208281-A2 | Quinoline 8-carboxylic-acid azolides, process for their preparation and their use as herbicides | BASF Aktiengesellschaft (DE) | 1987-01-14 | — | — | EP | disclosed |