Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.53 |
| ▸ | GBA1 | P04062 | 2/20 | 0.53 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.51 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.51 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.51 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.51 |
| ▸ | KIT | P10721 | 1/20 | 0.48 |
| ▸ | CKS1B | P61024 | 2/20 | 0.48 |
| ▸ | SKP1 | P63208 | 2/20 | 0.48 |
| ▸ | SKP2 | Q13309 | 2/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.47 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.46 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.46 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 1/20 | 0.46 |
| ▸ | TLR9 | Q9NR96 | 4/20 | 0.45 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.45 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30903377 | 1.00 | BACE1 (0.53) | BACE1GBA1OPRM1OPRD1OGFRL1 | |
| SCHEMBL24970896 | 0.87 | GBA1 (0.53) | BACE1GBA1OPRM1OPRD1OGFRL1 | |
| SCHEMBL31143062 | 0.86 | BACE1 (0.56) | BACE1GBA1OPRM1OPRD1OGFRL1 | |
| SCHEMBL24970895 | 0.86 | BACE1 (0.53) | BACE1GBA1OPRM1OPRD1OGFRL1 | |
| SCHEMBL24970897 | 0.83 | L3MBTL1 (0.55) | BACE1GBA1OPRM1OPRD1OGFRL1 | |
| SCHEMBL30819461 | 0.81 | GBA1 (0.56) | BACE1GBA1OPRM1OPRD1OGFRL1 | |
| SCHEMBL24951551 | 0.81 | GBA1 (0.56) | BACE1GBA1OPRM1OPRD1OGFRL1 | |
| SCHEMBL31143071 | 0.80 | BACE1 (0.56) | BACE1GBA1OPRM1OPRD1OGFRL1 | |
| SCHEMBL24970892 | 0.80 | BACE1 (0.56) | BACE1GBA1OPRM1OPRD1OGFRL1 | |
| SCHEMBL31143019 | 0.80 | HTR3B (0.57) | BACE1GBA1OPRM1OPRD1OGFRL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118076585-A | Gram negative bacteria efflux pump inhibitors | 国家医疗保健研究所 | 2024-05-24 | — | — | CN | disclosed |
| WO-2023002011-A1 | GRAM-NEGATIVE BACTERIA EFFLUX PUMP INHIBITORS | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2023-01-26 | — | — | WO | disclosed |