Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.50 |
| ▸ | KCNQ4 | P56696 | 3/20 | 0.41 |
| ▸ | KCNQ5 | Q9NR82 | 3/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | METAP1 | P53582 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESRRG | P62508 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1256341 | 1.00 | CYP17A1 (0.50) | CYP17A1KCNQ4KCNQ5RXFP1CA12 | |
| SCHEMBL3784938 | 0.87 | HPGD (0.44) | CYP17A1KCNQ4KCNQ5RXFP1CA12 | |
| SCHEMBL21682754 | 0.84 | SMN1; SMN2 (0.44) | CYP17A1KCNQ4KCNQ5RXFP1CA12 | |
| SCHEMBL857284 | 0.82 | HTT (0.55) | CYP17A1KCNQ4KCNQ5HTTLMNA | |
| SCHEMBL15925258 | 0.82 | CYP17A1 (0.54) | CYP17A1KCNQ4KCNQ5RXFP1CA12 | |
| SCHEMBL169631 | 0.82 | HTT (0.44) | HTTLMNAPOLBNPSR1 | |
| SCHEMBL29952945 | 0.81 | LMNA (0.41) | RXFP1CA12CA1CA9HIF1A | |
| SCHEMBL2363945 | 0.81 | CYP17A1 (0.53) | CYP17A1KCNQ4KCNQ5RXFP1HTT | |
| SCHEMBL29834708 | 0.81 | CYP17A1 (0.53) | CYP17A1KCNQ4KCNQ5RXFP1HTT | |
| SCHEMBL6134887 | 0.81 | ATR (0.45) | CYP17A1RXFP1CA12CA1CA9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119301105-A | Thiostrepton-based compounds for the treatment of cancer and preparation thereof | RS肿瘤学有限责任公司 | 2025-01-10 | — | — | CN | disclosed |
| WO-2024131893-A1 | IRE1α SMALL MOLECULE INHIBITORS | SHANGHAI YI ZHONG XING BIOTECHNOLOGY CO., LTD. (CN) | 2024-06-27 | — | — | WO | disclosed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |