Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HMGCR | P04035 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.30 |
| ▸ | CPT2 | P23786 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Chloroform SCHEMBL6213016 | 0.86 | CYP2D6 (0.37) | CYP2D6TSHRCYP2C19HIF1AALDH1A1 | |
| Propionic Acid SCHEMBL29191775 | 0.82 | FFAR3 (0.50) | CYP2D6TSHRCYP2C19HIF1AFFAR3 | |
| SCHEMBL110318 | 0.82 | CYP2D6 (0.48) | CYP2D6TSHRCYP2C19HIF1AFFAR3 | |
| SCHEMBL9145025 | 0.82 | CYP2D6 (0.48) | CYP2D6TSHRCYP2C19HIF1AFFAR3 | |
| SCHEMBL4324915 | 0.80 | CYP2D6 (0.46) | CYP2D6TSHRCYP2C19HIF1AFFAR3 | |
| SCHEMBL13044552 | 0.79 | ALDH1A1 (0.46) | CYP2D6TSHRCYP2C19HIF1AALDH1A1 | |
| SCHEMBL9747466 | 0.79 | ALDH1A1 (0.46) | CYP2D6TSHRCYP2C19HIF1AALDH1A1 | |
| SCHEMBL39652 | 0.79 | FFAR3 (0.35) | CYP2D6TSHRCYP2C19HIF1AFFAR3 | |
| SCHEMBL3465123 | 0.79 | FFAR3 (0.35) | CYP2D6TSHRCYP2C19HIF1AFFAR3 | |
| SCHEMBL1683780 | 0.79 | FFAR3 (0.35) | CYP2D6TSHRCYP2C19HIF1AFFAR3 |
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-20060040344-A1 | Microbial process for the preparation of 7-keto dehydroepiandrosterone and related analogs | WHITE MICHAEL J | 2006-02-23 | — | — | US | disclosed |