Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | BCR | P11274 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL31164769 | 0.79 | ASIC3 (0.55) | DRD2PDPK1LOXL2 | |
| SCHEMBL28403784 | 0.77 | DRD2 (0.63) | DRD2DRD4PIK3CDS1PR1S1PR3 | |
| SCHEMBL29756191 | 0.77 | DRD2 (0.63) | DRD2DRD4PIK3CDS1PR1S1PR3 | |
| SCHEMBL9952071 | 0.76 | DRD2 (0.42) | DRD2DRD4PIK3CDS1PR1S1PR3 | |
| SCHEMBL27410695 | 0.76 | PDPK1 (0.47) | PDPK1LOXL2ADRB2CYP2A6CHEK1 | |
| SCHEMBL1459657 | 0.75 | PDE3B (0.60) | CHEK1 | |
| SCHEMBL8528347 | 0.74 | DRD2 (0.47) | DRD2DRD4PIK3CDS1PR1CYP2A6 | |
| SCHEMBL3874468 | 0.74 | PDPK1 (0.46) | PDPK1LOXL2ADRB2CYP2A6CHEK1 | |
| SCHEMBL20953202 | 0.74 | DRD2 (0.38) | DRD2DRD4PIK3CDS1PR1S1PR3 | |
| SCHEMBL2200009 | 0.73 | SLC6A11 (0.47) | DRD2DRD4S1PR1CYP2A6HDAC2 |
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-111471037-B | Allylamine compound and application thereof | 药捷安康(南京)科技股份有限公司 | 2023-02-10 | — | — | CN | disclosed |
| CN-111471037-A | Allylamine compound and application thereof | 南京药捷安康生物科技有限公司 | 2020-07-31 | — | — | CN | disclosed |