Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPA1 | P15085 | 2/20 | 0.43 |
| ▸ | CPB1 | P15086 | 1/20 | 0.43 |
| ▸ | CPA3 | P15088 | 1/20 | 0.43 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 3/20 | 0.39 |
| ▸ | FFAR2 | O15552 | 5/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP12 | P39900 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | MLNR | O43193 | 1/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CTSD | P07339 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL28619292 | 1.00 | CPA1 (0.43) | CPA1CPB1CPA3CPB2LTA4H | |
| SCHEMBL21994399 | 1.00 | CPA1 (0.43) | CPA1CPB1CPA3CPB2LTA4H | |
| SCHEMBL21994397 | 1.00 | CPA1 (0.43) | CPA1CPB1CPA3CPB2LTA4H | |
| SCHEMBL30191669 | 0.90 | ITGB1 (0.38) | LTA4HMLNRABCB11LMNACTSD | |
| SCHEMBL30191824 | 0.90 | ITGB1 (0.38) | LTA4HMLNRABCB11LMNACTSD | |
| SCHEMBL30191684 | 0.81 | FFAR2 (0.32) | FFAR2MLNRABCB11LMNACTSD | |
| SCHEMBL21995147 | 0.79 | KMT2A (0.40) | CPA1CPB1CPA3CPB2LTA4H | |
| SCHEMBL21995149 | 0.79 | KMT2A (0.40) | CPA1CPB1CPA3CPB2LTA4H | |
| SCHEMBL30191593 | 0.74 | ABCB1 (0.40) | LTA4H | |
| SCHEMBL30191155 | 0.72 | KMT2A (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-113166101-A | Cyclic pentameric compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders | 诺华股份有限公司 | 2021-07-23 | — | — | CN | disclosed |