Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | NQO2 | P16083 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.39 |
| ▸ | GRK5 | P34947 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5864975 | 1.00 | TSHR (0.48) | TSHRALDH1A1HTTMAPTCYP19A1 | |
| SCHEMBL220662 | 0.85 | CYP19A1 (0.50) | TSHRALDH1A1HTTMAPTCYP19A1 | |
| SCHEMBL2437759 | 0.85 | TSHR (0.58) | TSHRALDH1A1HTTMAPTCYP19A1 | |
| Ammonia Solution, Strong SCHEMBL28208001 | 0.83 | TSHR (0.56) | TSHRALDH1A1HTTMAPTCYP19A1 | |
| Ammonia Solution, Strong SCHEMBL28007719 | 0.81 | CYP19A1 (0.46) | TSHRALDH1A1HTTMAPTCYP19A1 | |
| SCHEMBL31481313 | 0.76 | MAPT (0.51) | TSHRALDH1A1HTTMAPTCYP19A1 | |
| SCHEMBL899149 | 0.76 | TSHR (0.48) | TSHRALDH1A1HTTMAPTCYP19A1 | |
| SCHEMBL5652028 | 0.76 | TSHR (0.48) | TSHRALDH1A1HTTMAPTCYP19A1 | |
| SCHEMBL4046351 | 0.76 | TSHR (0.44) | TSHRALDH1A1HTTMAPTCYP19A1 | |
| SCHEMBL22834291 | 0.76 | LMNA (0.50) | TSHRALDH1A1HTTMAPTCYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022122044-A1 | HETEROCYCLIC COMPOUND SERVING AS GLS1 INHIBITOR | 杭州紫晶医药科技有限公司 | 2022-06-16 | — | — | WO | disclosed |