Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA3 | P07451 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13014690 | 0.90 | KCNH2 (0.44) | MAOAMAOBCYP19A1CYP11B1CYP11B2 | |
| SCHEMBL9906430 | 0.89 | KCNH2 (0.46) | MAOAMAOBCYP19A1CYP11B1CYP11B2 | |
| SCHEMBL21677893 | 0.84 | CYP19A1 (0.35) | CYP19A1 | |
| SCHEMBL21678034 | 0.84 | CYP19A1 (0.35) | CYP19A1 | |
| SCHEMBL1225841 | 0.83 | TSHR (0.50) | MAOAMAOBCYP19A1ALDH1A1CYP2A6 | |
| SCHEMBL1225840 | 0.83 | TSHR (0.50) | MAOAMAOBCYP19A1ALDH1A1CYP2A6 | |
| SCHEMBL1226208 | 0.83 | TSHR (0.50) | MAOAMAOBCYP19A1ALDH1A1CYP2A6 | |
| SCHEMBL7879783 | 0.80 | DRD2 (0.50) | KCNH2 | |
| SCHEMBL136333 | 0.80 | DRD2 (0.50) | KCNH2 | |
| Hydrochloric Acid SCHEMBL966629 | 0.78 | — | — |
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-115612435-A | High-temperature-resistant polyurethane adhesive for sealing and preparation method thereof | 唯万科技有限公司 | 2023-01-17 | — | — | CN | disclosed |