Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.34 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | DRD3 | P35462 | 2/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 8/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30082721 | 0.84 | CA1 (0.32) | CA1CA2ACHECYP1A2CYP11B1 | |
| SCHEMBL23364899 | 0.82 | CYP1A2 (0.35) | CA1CA2ACHECYP1A2CYP11B1 | |
| SCHEMBL23364990 | 0.82 | CYP2C9 (0.40) | CYP1A2CYP11B1CYP11B2CYP3A4CYP2C9 | |
| SCHEMBL29113480 | 0.78 | CYP1A2 (0.37) | ACHECYP1A2CYP11B1CYP11B2CYP3A4 | |
| SCHEMBL30612410 | 0.78 | CYP1A2 (0.37) | ACHECYP1A2CYP11B1CYP11B2CYP3A4 | |
| SCHEMBL3806985 | 0.76 | PLAU (0.41) | CA1CA2CYP19A1MTNR1AMTNR1B | |
| SCHEMBL356130 | 0.74 | DRD2 (0.55) | CA1CA2ACHEDRD2DRD3 | |
| SCHEMBL29851851 | 0.74 | CYP1A2 (0.33) | CYP1A2CYP11B1CYP11B2CYP3A4CYP2C9 | |
| SCHEMBL14812350 | 0.71 | DRD2 (0.51) | CA1CA2ACHECYP1A2CYP11B1 | |
| SCHEMBL354259 | 0.70 | MTNR1A (0.39) | CA1CA2ACHEMTNR1AMTNR1B |
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 |
|---|---|---|---|---|---|---|---|
| CN-115297930-A | Antimicrobial compounds and methods | 库扎环球有限责任公司 | 2022-11-04 | — | — | CN | disclosed |