Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STS | P08842 | 7/20 | 0.47 |
| ▸ | SHBG | P04278 | 2/20 | 0.47 |
| ▸ | ABCC4 | O15439 | 3/20 | 0.46 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.46 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.44 |
| ▸ | ESR1 | P03372 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.43 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | SERPINA6 | P08185 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1259385 | 0.85 | SHBG (0.67) | STSSHBGABCC4ABCC1CYP2C9 | |
| SCHEMBL3381342 | 0.85 | SHBG (0.67) | STSSHBGABCC4ABCC1CYP2C9 | |
| SCHEMBL2163618 | 0.82 | SHBG (0.68) | STSSHBGCYP2C9HSD17B1ESR1 | |
| SCHEMBL2849786 | 0.82 | HSD17B1 (0.48) | STSSHBGHSD17B1ESR1CYP3A4 | |
| SCHEMBL712799 | 0.79 | STS (0.70) | STSSHBGABCC4ABCC1CYP2C9 | |
| SCHEMBL9238193 | 0.79 | SRD5A2 (0.54) | STSSHBGHSD17B1ESR1CYP3A4 | |
| SCHEMBL6869676 | 0.79 | STS (0.70) | STSSHBGABCC4ABCC1CYP2C9 | |
| SCHEMBL2852317 | 0.79 | STS (0.73) | STSESR1ESR2CA1CA2 | |
| SCHEMBL3908652 | 0.78 | ABCC1 (0.70) | STSSHBGABCC4ABCC1CYP2C9 | |
| SCHEMBL5707602 | 0.77 | ESR1 (0.56) | STSSHBGABCC4ABCC1CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1594884-B1 | ANTITUMORAL 18A-HOMOESTRA-1,3,5(10)-TRIEN-3-YL 2-SUBSTITUTED SULFAMATES | STERIX LTD (GB) | 2010-01-13 | — | — | EP | disclosed |