Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.41 |
| ▸ | CES1 | P23141 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.33 |
| ▸ | CHRNG | P07510 | 1/20 | 0.33 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | CHRND | Q07001 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.33 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23958880 | 0.80 | CES2 (0.45) | CES2CES1MAOAMAOBRAB9A | |
| SCHEMBL6963321 | 0.69 | CES2 (0.54) | CES2CES1MAOAMAOBRAB9A | |
| SCHEMBL23904715 | 0.68 | MAOA (0.38) | CES2CES1MAOAMAOBPOLB | |
| SCHEMBL8802041 | 0.67 | CES2 (0.52) | CES2CES1MAOAMAOBRAB9A | |
| SCHEMBL23958935 | 0.67 | MAOA (0.37) | CES2CES1MAOAMAOBRAB9A | |
| SCHEMBL16961038 | 0.66 | CES2 (0.50) | CES2CES1MAOAMAOBRAB9A | |
| SCHEMBL16952380 | 0.66 | CES2 (0.50) | CES2CES1MAOAMAOBRAB9A | |
| SCHEMBL16795682 | 0.66 | CES2 (0.50) | CES2CES1MAOAMAOBRAB9A | |
| SCHEMBL10040527 | 0.66 | DGAT1 (0.50) | CES2CES1MAOAMAOBRAB9A | |
| SCHEMBL6682774 | 0.66 | GAA (0.54) | CES2CES1RAB9AMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021214136-A1 | RSV INHIBITING 3-SUBSTITUTED QUINOLINE AND CINNOLINE DERIVATIVES | Janssen Sciences Ireland Unlimited Company (IE) | 2021-10-28 | — | — | WO | disclosed |