Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.60 |
| ▸ | LMNA | P02545 | 4/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | PGR | P06401 | 1/20 | 0.60 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.60 |
| ▸ | AR | P10275 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 1/20 | 0.60 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.60 |
| ▸ | DRD1 | P21728 | 1/20 | 0.60 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.60 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.60 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.60 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL18926564 | 0.85 | ESR1 (0.83) | ESR1LMNACYP1A2PGRCHRM2 | |
| P-Cresol SCHEMBL28072492 | 0.81 | ACHE (0.56) | ESR1LMNACYP1A2PGRCHRM2 | |
| Hexestrol SCHEMBL17628536 | 0.81 | ESR1 (0.83) | ESR1LMNACYP1A2PGRCHRM2 | |
| SCHEMBL3861713 | 0.81 | HKDC1 (0.55) | ESR1LMNACYP1A2PGRCHRM2 | |
| Ammonia Solution, Strong SCHEMBL18191766 | 0.79 | HKDC1 (0.53) | ESR1LMNACYP1A2PGRCHRM2 | |
| P-Cresol SCHEMBL28213196 | 0.79 | ACHE (0.48) | ESR1LMNACYP1A2PGRCHRM2 | |
| SCHEMBL12049665 | 0.77 | ACHE (0.56) | ESR1LMNACYP1A2PGRCHRM2 | |
| SCHEMBL1151700 | 0.77 | ESR1 (0.47) | ESR1LMNACYP1A2PGRCHRM2 | |
| SCHEMBL735987 | 0.77 | ACHE (0.68) | ESR1LMNACYP1A2PGRCHRM2 | |
| SCHEMBL20763933 | 0.77 | ACHE (0.68) | ESR1LMNACYP1A2PGRCHRM2 |
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-2023023531-A1 | ESTROGEN RECEPTOR DEGRADERS, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS | BIOTHERYX, INC. (US) | 2023-02-23 | — | — | WO | disclosed |