Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL18333661 | 0.89 | ALDH1A1 (0.38) | TSHRCYP3A4MEN1KMT2AALDH1A1 | |
| SCHEMBL7625494 | 0.85 | ALDH1A1 (0.40) | TSHRCYP3A4MEN1KMT2AALDH1A1 | |
| SCHEMBL29192594 | 0.84 | TSHR (0.36) | TSHRCYP3A4MEN1KMT2AALDH1A1 | |
| SCHEMBL2558765 | 0.84 | ZDHHC20 (0.38) | TSHRCYP3A4MEN1KMT2AALDH1A1 | |
| SCHEMBL18329144 | 0.83 | MEN1 (0.43) | TSHRCYP3A4MEN1KMT2AALDH1A1 | |
| SCHEMBL9398466 | 0.83 | TSHR (0.37) | TSHRCYP3A4MEN1KMT2AALDH1A1 | |
| SCHEMBL29192590 | 0.82 | ZDHHC20 (0.42) | TSHRCYP3A4MEN1KMT2AALDH1A1 | |
| SCHEMBL363117 | 0.81 | ALDH1A1 (0.37) | TSHRCYP3A4MEN1KMT2AALDH1A1 | |
| SCHEMBL5885009 | 0.81 | ALDH1A1 (0.37) | TSHRCYP3A4MEN1KMT2AALDH1A1 | |
| SCHEMBL29192537 | 0.81 | ZDHHC20 (0.45) | TSHRCYP3A4MEN1KMT2AALDH1A1 |
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-117585963-A | Shrinkage-reducing anti-cracking type large-volume concrete and preparation method thereof | 中建商品混凝土有限公司 | 2024-02-23 | — | — | CN | claimed |
| CN-117585963-A | Shrinkage-reducing anti-cracking type large-volume concrete and preparation method thereof | 中建商品混凝土有限公司 | 2024-02-23 | — | — | CN | disclosed |