Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | CXCR3 | P49682 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1758544 | 0.89 | CCR1 (0.53) | CCR1GAACXCR3LMNAKDM4E | |
| SCHEMBL8513972 | 0.88 | CCR1 (0.52) | CCR1GAACXCR3LMNAKDM4E | |
| SCHEMBL2579871 | 0.85 | CCR1 (0.52) | CCR1GAACXCR3LMNAKDM4E | |
| SCHEMBL25757616 | 0.84 | GAA (0.47) | CCR1GAALMNAKDM4ETP53 | |
| SCHEMBL8513975 | 0.84 | CCR1 (0.54) | CCR1GAACXCR3LMNAKDM4E | |
| SCHEMBL28799628 | 0.82 | CCR1 (0.50) | CCR1GAACXCR3LMNAKDM4E | |
| SCHEMBL25757726 | 0.81 | CCR1 (0.51) | CCR1GAACXCR3LMNAKDM4E | |
| SCHEMBL1758546 | 0.81 | CCR1 (0.54) | CCR1GAACXCR3LMNAKDM4E | |
| SCHEMBL1758419 | 0.81 | GAA (0.49) | CCR1GAACXCR3LMNAKDM4E | |
| SCHEMBL27863436 | 0.81 | CCR1 (0.53) | CCR1GAACXCR3LMNAKDM4E |
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-2023098738-A1 | COMPOUND CONTAINING OXADIAZOLE STRUCTURE AND PREPARATION METHOD THEREFOR AND USE THEREOF, AND FUNGICIDE | 江苏中旗科技股份有限公司 | 2023-06-08 | — | — | WO | disclosed |