Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 6/20 | 0.39 |
| ▸ | CNR1 | P21554 | 3/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | MITF | O75030 | 1/20 | 0.37 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | STAT1 | P42224 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25687041 | 1.00 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1CNR2CNR1DHODH | |
| SCHEMBL23930265 | 0.76 | ADORA2A (0.40) | ALDH1A1L3MBTL1CNR2CNR1ADORA2A | |
| SCHEMBL30211277 | 0.74 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1CNR2KDM4EADORA2A | |
| SCHEMBL23930189 | 0.74 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1CNR2KDM4EADORA2A | |
| SCHEMBL30211257 | 0.74 | S1PR2 (0.43) | ALDH1A1DHODHKDM4EADORA2AADORA3 | |
| SCHEMBL23930268 | 0.72 | — | — | |
| SCHEMBL30007093 | 0.72 | — | — | |
| SCHEMBL23958637 | 0.71 | SLC34A1 (0.35) | ALDH1A1CNR2CNR1DHODHADORA2A | |
| SCHEMBL12228876 | 0.71 | TDO2 (0.41) | ALDH1A1L3MBTL1RAB9ANPC1CYP3A4 | |
| SCHEMBL30007279 | 0.71 | SLC34A1 (0.35) | ALDH1A1CNR2CNR1DHODHADORA2A |
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-4139293-A1 | RSV INHIBITING 3-SUBSTITUTED QUINOLINE AND CINNOLINE DERIVATIVES | Janssen Sciences Ireland Unlimited Company (IE) | 2023-03-01 | — | — | EP | disclosed |
| CN-115461336-A | RSV inhibiting 3-substituted quinoline and cinnoline derivatives | 爱尔兰詹森科学公司 | 2022-12-09 | — | — | CN | disclosed |