Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 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 | |
|---|---|---|---|---|
| SCHEMBL16413144 | 1.00 | TSHR (0.44) | TSHRGSTO1ALDH1A1PARP1CA1 | |
| SCHEMBL25852682 | 0.84 | BACE1 (0.38) | TSHRGSTO1PARP1 | |
| SCHEMBL30683569 | 0.84 | BACE1 (0.38) | TSHRGSTO1PARP1 | |
| SCHEMBL24424975 | 0.80 | TSHR (0.55) | TSHRGSTO1PARP1CHRM2CHRM4 | |
| SCHEMBL871294 | 0.80 | TSHR (0.55) | TSHRGSTO1PARP1CHRM2CHRM4 | |
| SCHEMBL7786250 | 0.80 | HTR1A (0.38) | TSHRCHRM2 | |
| SCHEMBL6481069 | 0.77 | TSHR (0.54) | TSHRGSTO1PARP1CHRM2CHRM4 | |
| SCHEMBL1499496 | 0.77 | TSHR (0.54) | TSHRGSTO1PARP1CHRM2CHRM4 | |
| SCHEMBL7779276 | 0.77 | TSHR (0.54) | TSHRGSTO1PARP1CHRM2CHRM4 | |
| SCHEMBL17141371 | 0.75 | TSHR (0.41) | TSHRGSTO1PARP1CHRM2CHRM4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4212531-A1 | AZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS | AGV Discovery (FR) | 2023-07-19 | — | — | EP | disclosed |
| CN-109180482-A | Vegetable oil polyalcohol and preparation method and application thereof | 南京工业大学 | 2019-01-11 | — | — | CN | disclosed |