Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 7/20 | 0.43 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | RARA | P10276 | 1/20 | 0.33 |
| ▸ | RARB | P10826 | 1/20 | 0.33 |
| ▸ | RARG | P13631 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28103596 | 1.00 | PTGS2 (0.43) | PTGS2NPY5RCHRNA7ATMGRM5 | |
| SCHEMBL28103545 | 0.84 | PTGS2 (0.45) | PTGS2NPY5RCHRNA7ATMGRM5 | |
| SCHEMBL28103540 | 0.84 | PTGS2 (0.45) | PTGS2NPY5RCHRNA7ATMGRM5 | |
| SCHEMBL28103886 | 0.84 | PTGS2 (0.45) | PTGS2NPY5RCHRNA7ATMGRM5 | |
| SCHEMBL28315037 | 0.84 | PTGS2 (0.42) | PTGS2NPY5RCHRNA7ATMGRM5 | |
| SCHEMBL28103862 | 0.82 | PTGS2 (0.57) | PTGS2NPY5RCHRNA7ATMGRM5 | |
| SCHEMBL28315052 | 0.81 | GRM5 (0.53) | PTGS2NPY5RGRM5KMT2AEPHX2 | |
| SCHEMBL28103563 | 0.81 | GRM5 (0.53) | PTGS2NPY5RGRM5KMT2AEPHX2 | |
| SCHEMBL28103506 | 0.81 | PTGS2 (0.45) | PTGS2NPY5RATMGRM5EPHX2 | |
| SCHEMBL28315124 | 0.81 | PTGS2 (0.45) | PTGS2NPY5RCHRNA7ATMGRM5 |
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-106146479-B | A kind of effective compound and the preparation method and application thereof inhibited or kill multiple drug resistant bacteria | 清华大学 | 2019-07-12 | — | — | CN | disclosed |
| CN-106146479-A | A kind of effective suppression or the compound killing multiple drug resistant bacteria and preparation method and application | 清华大学 | 2016-11-23 | — | — | CN | disclosed |