Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | TGM2 | P21980 | 2/20 | 0.34 |
| ▸ | F13A1 | P00488 | 1/20 | 0.34 |
| ▸ | TGM1 | P22735 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19990696 | 0.84 | — | — | |
| SCHEMBL28695065 | 0.84 | NR1H2 (0.39) | CYP1A2POLBCYP3A4CYP2C19NR1H2 | |
| SCHEMBL23927102 | 0.78 | CYP1A2 (0.34) | CYP1A2POLBCYP3A4CYP2C19NR1H2 | |
| SCHEMBL19865492 | 0.72 | CHRM2 (0.47) | CYP1A2POLBCYP3A4CYP2C19NR1H2 | |
| SCHEMBL20713877 | 0.72 | CHRM2 (0.47) | CYP1A2POLBCYP3A4CYP2C19NR1H2 | |
| SCHEMBL3971244 | 0.71 | CYP1A2 (0.42) | CYP1A2POLBCYP3A4CYP2C19NR1H2 | |
| SCHEMBL1267927 | 0.71 | CYP1A2 (0.42) | CYP1A2POLBCYP3A4CYP2C19NR1H2 | |
| SCHEMBL12836636 | 0.71 | CYP1A2 (0.42) | CYP1A2POLBCYP3A4CYP2C19NR1H2 | |
| SCHEMBL1268152 | 0.71 | CYP1A2 (0.42) | CYP1A2POLBCYP3A4CYP2C19NR1H2 | |
| SCHEMBL178642 | 0.71 | CYP1A2 (0.42) | CYP1A2POLBCYP3A4CYP2C19NR1H2 |
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-109843894-B | Beta-lactamase inhibitors | 诺华股份有限公司 | 2022-02-08 | — | — | CN | disclosed |
| EP-3698796-B1 | PHARMACEUTICAL COMBINATION OF A TRICYCLIC BETA-LACTAMASE INHIBITOR WITH SPECIFIC BETA-LACTAM ANTIBIOTICS | NOVARTIS AG (CH) | 2021-10-27 | — | — | EP | disclosed |