Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.57 |
| ▸ | SHBG | P04278 | 3/20 | 0.57 |
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.57 |
| ▸ | AR | P10275 | 2/20 | 0.57 |
| ▸ | SERPINA6 | P08185 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.57 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.57 |
| ▸ | PGR | P06401 | 1/20 | 0.57 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.57 |
| ▸ | MGAM | O43451 | 1/20 | 0.57 |
| ▸ | PRKCA | P17252 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL145680 | 1.00 | CYP19A1 (0.57) | CYP19A1SHBGGPBAR1ARSERPINA6 | |
| SCHEMBL11332329 | 1.00 | CYP19A1 (0.57) | CYP19A1SHBGGPBAR1ARSERPINA6 | |
| Acetic Acid SCHEMBL636808 | 0.95 | CYP19A1 (0.53) | CYP19A1SHBGGPBAR1ARSERPINA6 | |
| SCHEMBL10891187 | 0.87 | CYP19A1 (0.56) | CYP19A1SHBGGPBAR1ARSERPINA6 | |
| SCHEMBL10891182 | 0.87 | CYP19A1 (0.56) | CYP19A1SHBGGPBAR1ARSERPINA6 | |
| Acetic Acid Pentyl Ester SCHEMBL27748017 | 0.86 | CYP19A1 (0.44) | CYP19A1SHBGGPBAR1ARSERPINA6 | |
| SCHEMBL11324212 | 0.83 | MBOAT4 (0.46) | CYP19A1SHBGGPBAR1ARSERPINA6 | |
| SCHEMBL11324207 | 0.83 | MBOAT4 (0.46) | CYP19A1SHBGGPBAR1ARSERPINA6 | |
| SCHEMBL7082952 | 0.82 | MBOAT4 (0.45) | CYP19A1SHBGGPBAR1ARSERPINA6 | |
| SCHEMBL7082956 | 0.82 | MBOAT4 (0.45) | CYP19A1SHBGGPBAR1ARSERPINA6 |
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-20150152348-A1 | SYSTEMS AND METHODS FOR COLLECTING, TRANSPORTING AND REPURPOSING OR DESTROYING UNUSED PHARMACEUTICALS | SHARPS COMPLIANCE, INC. OF TEXAS | 2015-06-04 | — | — | US | disclosed |
| US-20080207601-A1 | Methods of and Compositions For the Prevention of Anxiety, Substance Abuse, and Dependence | HYTHIAM , INC. (US) | 2008-08-28 | — | — | US | disclosed |
| US-20080075772-A1 | PHARMACEUTICAL COMPOSITIONS HAVING NOVEL SCORING PATTERNS AND METHODS OF USING THOSE COMPOSITIONS | ACCU-BREAK TECHNOLOGIES, INC. | 2008-03-27 | — | — | US | disclosed |
| US-4297350-A | ORAL ANTIFERTILITY AGENTS; REVERSIBLE | THE UPJOHN COMPANY (US) | 1981-10-27 | — | — | US | disclosed |