Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STS | P08842 | 10/20 | 0.80 |
| ▸ | CYP19A1 | P11511 | 9/20 | 0.80 |
| ▸ | HSD17B1 | P14061 | 4/20 | 0.66 |
| ▸ | LMNA | P02545 | 2/20 | 0.66 |
| ▸ | ESR1 | P03372 | 2/20 | 0.66 |
| ▸ | MAPT | P10636 | 2/20 | 0.66 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.66 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.66 |
| ▸ | SHBG | P04278 | 1/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | PGR | P06401 | 1/20 | 0.66 |
| ▸ | SERPINA6 | P08185 | 1/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.66 |
| ▸ | AR | P10275 | 1/20 | 0.66 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.66 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.66 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.66 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.66 |
| ▸ | SNCA | P37840 | 1/20 | 0.66 |
| ▸ | HTR2B | P41595 | 1/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL223170 | 1.00 | STS (0.80) | STSCYP19A1HSD17B1LMNAESR1 | |
| Sulfuric Acid SCHEMBL21408951 | 0.95 | STS (0.74) | STSCYP19A1HSD17B1LMNAESR1 | |
| SCHEMBL978711 | 0.90 | STS (0.77) | STSCYP19A1HSD17B1LMNAESR1 | |
| SCHEMBL13930486 | 0.89 | STS (1.00) | STSCYP19A1HSD17B1LMNAESR1 | |
| SCHEMBL10889130 | 0.89 | CYP19A1 (1.00) | STSCYP19A1HSD17B1LMNAESR1 | |
| SCHEMBL14048663 | 0.89 | STS (0.75) | STSCYP19A1HSD17B1LMNAESR1 | |
| SCHEMBL2929474 | 0.89 | STS (1.00) | STSCYP19A1HSD17B1LMNAESR1 | |
| SCHEMBL1705295 | 0.89 | STS (0.75) | STSCYP19A1HSD17B1LMNAESR1 | |
| SCHEMBL10783004 | 0.89 | STS (0.75) | STSCYP19A1HSD17B1LMNAESR1 | |
| SCHEMBL13930484 | 0.89 | STS (0.75) | STSCYP19A1HSD17B1LMNAESR1 |
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-7807472-B2 | Methods for separation and detection of ketosteroids and other carbonyl-containing compounds | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2010-10-05 | — | — | US | disclosed |
| US-7807472-B2 | Methods for separation and detection of ketosteroids and other carbonyl-containing compounds | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2010-10-05 | — | — | US | disclosed |
| US-7445909-B2 | Method for detecting reactive metabolites using a combination of glutathione and a stable isotopic derivative of glutathione and mass spectroscopy-based pattern recognition | JANSSEN PHAMACEUTICA N.V. (BE) | 2008-11-04 | — | — | US | disclosed |
| US-7445909-B2 | Method for detecting reactive metabolites using a combination of glutathione and a stable isotopic derivative of glutathione and mass spectroscopy-based pattern recognition | JANSSEN PHAMACEUTICA N.V. (BE) | 2008-11-04 | — | — | US | disclosed |