Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | P2RY12 | Q9H244 | 5/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | NAMPT | P43490 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | SCD | O00767 | 1/20 | 0.41 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.41 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.41 |
| ▸ | WNT3A | P56704 | 1/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30223090 | 1.00 | SMN1; SMN2 (0.48) | SMN1; SMN2HTTNPSR1P2RY12MEN1 | |
| SCHEMBL31142916 | 0.92 | P2RY12 (0.51) | SMN1; SMN2HTTNPSR1P2RY12MEN1 | |
| SCHEMBL31142906 | 0.84 | P2RY12 (0.55) | P2RY12 | |
| SCHEMBL31142973 | 0.83 | P2RY12 (0.46) | SMN1; SMN2HTTNPSR1P2RY12MEN1 | |
| SCHEMBL29803419 | 0.79 | SMN1; SMN2 (0.47) | SMN1; SMN2HTTNPSR1MEN1KMT2A | |
| SCHEMBL29268342 | 0.78 | MEN1 (0.49) | SMN1; SMN2P2RY12MEN1KMT2AMAPT | |
| SCHEMBL24969726 | 0.78 | P2RY12 (0.46) | SMN1; SMN2HTTNPSR1P2RY12MEN1 | |
| SCHEMBL19212401 | 0.77 | P2RY12 (0.54) | P2RY12MEN1KMT2A | |
| SCHEMBL24971031 | 0.77 | SLC2A1 (0.43) | SMN1; SMN2HTTNPSR1P2RY12NAMPT | |
| SCHEMBL31142855 | 0.77 | SLC2A1 (0.43) | SMN1; SMN2HTTNPSR1P2RY12NAMPT |
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 |