Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 5/20 | 0.39 |
| ▸ | PPARD | Q03181 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28193503 | 0.90 | ALDH1A1 (0.37) | THRBTSHRALDH1A1CYP3A4 | |
| SCHEMBL4167475 | 0.89 | TSHR (0.48) | THRBTSHRPPARDALDH1A1CA12 | |
| SCHEMBL28292301 | 0.87 | CYP3A4 (0.48) | THRBTSHRALDH1A1CYP3A4 | |
| SCHEMBL3630684 | 0.86 | TSHR (0.48) | THRBTSHRPPARDALDH1A1CA12 | |
| Trimethylammonium SCHEMBL8027821 | 0.84 | TSHR (0.43) | THRBTSHRPPARDALDH1A1CA12 | |
| SCHEMBL27836992 | 0.84 | THRB (0.38) | THRBTSHRALDH1A1CA12CA1 | |
| SCHEMBL25398870 | 0.83 | SMN1; SMN2 (0.39) | THRBTSHR | |
| SCHEMBL19833987 | 0.83 | TSHR (0.35) | THRBTSHR | |
| SCHEMBL491086 | 0.82 | TSHR (0.43) | THRBTSHRALDH1A1CYP3A4 | |
| SCHEMBL28068530 | 0.82 | BTN3A1 (0.40) | THRBTSHRPPARDALDH1A1 |
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-105646794-B | The preparation method and application of collapse protection type phosphate super plasticizer | 江苏苏博特新材料股份有限公司 | 2018-01-23 | — | — | CN | disclosed |
| CN-104955784-B | Hardening accelerator composition | 巴斯夫欧洲公司 | 2018-01-05 | — | — | CN | disclosed |