Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 12/20 | 0.78 |
| ▸ | ESR2 | Q92731 | 11/20 | 0.78 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.56 |
| ▸ | GLB1 | P16278 | 1/20 | 0.45 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.45 |
| ▸ | CTRC | Q99895 | 1/20 | 0.45 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | AGER | Q15109 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL3682920 | 0.89 | ESR1 (1.00) | ESR1ESR2ALOX15PDCD1CD274 | |
| SCHEMBL9296352 | 0.81 | ALDH1A1 (0.54) | ESR1ESR2ALOX15CYP3A4MAPT | |
| SCHEMBL9449569 | 0.80 | ESR1 (0.82) | ESR1ESR2PDCD1CD274LMNA | |
| SCHEMBL14982829 | 0.78 | ESR1 (0.78) | ESR1ESR2ALOX15PDCD1CD274 | |
| SCHEMBL835538 | 0.77 | ALOX15 (0.68) | ESR1ESR2ALOX15GLB1CTRB1 | |
| SCHEMBL17443 | 0.75 | — | — | |
| SCHEMBL6118114 | 0.75 | ALOX15 (1.00) | ESR1ESR2ALOX15GLB1CTRB1 | |
| SCHEMBL26988622 | 0.75 | ALOX15 (0.65) | ESR1ESR2ALOX15GLB1CTRB1 | |
| SCHEMBL12273874 | 0.74 | ESR1 (0.46) | ESR1ESR2ALOX15GLB1CTRB1 | |
| SCHEMBL12490983 | 0.74 | ESR1 (0.46) | ESR1ESR2ALOX15GLB1CTRB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5498803-A | SOLVENT RESISTANT POLYETHERS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) | 1996-03-12 | — | — | US | disclosed |