Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 1/20 | 0.51 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.50 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.50 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.50 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.50 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11058464 | 0.81 | SHBG (0.38) | SHBGADRB1ADRB3ADRB2HKDC1 | |
| Bifluranol SCHEMBL29928815 | 0.77 | SHBG (0.73) | SHBGADRB1ADRB3ADRB2HKDC1 | |
| Bifluranol SCHEMBL131387 | 0.77 | SHBG (0.73) | SHBGADRB1ADRB3ADRB2HKDC1 | |
| Bifluranol SCHEMBL1650515 | 0.77 | SHBG (0.73) | SHBGADRB1ADRB3ADRB2HKDC1 | |
| SCHEMBL15631292 | 0.74 | GABRA1 (0.61) | SHBGADRB1ADRB3ADRB2GABRA1 | |
| Bifluranol SCHEMBL23620730 | 0.72 | SHBG (0.65) | SHBGHKDC1ADRA2BESR1OPRM1 | |
| SCHEMBL9908615 | 0.71 | ADRB2 (0.44) | SHBGADRB1ADRB3ADRB2HKDC1 | |
| SCHEMBL25147626 | 0.71 | ADRB2 (0.44) | SHBGADRB1ADRB3ADRB2HKDC1 | |
| SCHEMBL13912410 | 0.70 | SHBG (0.64) | SHBGADRB1ADRB3ADRB2HKDC1 | |
| Acefluranol SCHEMBL2110861 | 0.69 | CYP4F2 (0.41) | SHBGESR1ALOX15LMNAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4427697-A | ANTIESTROGENS | BIOREX LABORATORIES LIMITED (GB) | 1984-01-24 | — | — | US | claimed |
| US-4427697-A | ANTIESTROGENS | BIOREX LABORATORIES LIMITED (GB) | 1984-01-24 | — | — | US | disclosed |