Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.49 |
| ▸ | ESR1 | P03372 | 6/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.46 |
| ▸ | CACNA1H | O95180 | 3/20 | 0.46 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.46 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | PDE5A | O76074 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 3/20 | 0.41 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | PRKCA | P17252 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3368570 | 0.87 | ESR1 (0.59) | ABCG2ESR1ESR2CACNA1HAKR1B10 | |
| SCHEMBL5430100 | 0.80 | ESR1 (0.43) | ABCG2ESR1ESR2CACNA1HAKR1B10 | |
| SCHEMBL22498697 | 0.79 | ABCG2 (0.78) | ABCG2ESR1ESR2CACNA1HAKR1B10 | |
| SCHEMBL29379960 | 0.79 | ABCG2 (0.78) | ABCG2ESR1ESR2CACNA1HAKR1B10 | |
| SCHEMBL4758125 | 0.73 | ESR2 (0.39) | ESR1ESR2AKR1B1PTGS2CYP19A1 | |
| SCHEMBL19221566 | 0.71 | ABCG2 (0.75) | ABCG2ESR1ESR2CACNA1HAKR1B10 | |
| SCHEMBL27950799 | 0.70 | TAS2R31 (0.39) | ESR1ESR2CYP19A1PTPN1MAPT | |
| Sophoraflavanone A SCHEMBL29624617 | 0.66 | ABCG2 (1.00) | ABCG2ESR1ESR2CACNA1HAKR1B10 | |
| Sophoraflavanone A SCHEMBL141996 | 0.66 | ABCG2 (1.00) | ABCG2ESR1ESR2CACNA1HAKR1B10 | |
| SCHEMBL349722 | 0.64 | CYP3A4 (0.52) | ESR1ESR2AKR1B1PTGS2TP53 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220128556-A1 | METHODS OF DIAGNOSING DISEASE | 4D Pharma Cork Limited (IE) | 2022-04-28 | — | — | US | disclosed |
| CN-114040986-A | Method of diagnosing disease | 4D制药科克有限公司 | 2022-02-11 | — | — | CN | disclosed |
| EP-3947743-A1 | METHODS OF DIAGNOSING DISEASE | 4D Pharma Cork Limited (IE) | 2022-02-09 | — | — | EP | disclosed |
| WO-2020201457-A1 | METHODS OF DIAGNOSING DISEASE | 4D Pharma Cork Limited (IE) | 2020-10-08 | — | — | WO | disclosed |