Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 1/20 | 0.53 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HSPA5 | P11021 | 2/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.36 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | G6PD | P11413 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL278742 | 0.94 | SHBG (0.59) | SHBGAMY1ACYP2C9CYP2C19HIF1A | |
| SCHEMBL30375057 | 0.94 | SHBG (0.59) | SHBGAMY1ACYP2C9CYP2C19HIF1A | |
| SCHEMBL278357 | 0.90 | SHBG (0.65) | SHBGAMY1ACYP2C9CYP2C19HIF1A | |
| SCHEMBL4063126 | 0.90 | SHBG (0.48) | SHBGAMY1ACYP2C9CYP2C19HIF1A | |
| SCHEMBL1057297 | 0.89 | CYP2C9 (0.51) | SHBGAMY1ACYP2C9CYP2C19HIF1A | |
| SCHEMBL29941774 | 0.88 | AMY1A (0.58) | SHBGAMY1ACYP2C9CYP2C19HIF1A | |
| SCHEMBL13609020 | 0.88 | AMY1A (0.58) | SHBGAMY1ACYP2C9CYP2C19HIF1A | |
| SCHEMBL278491 | 0.88 | AMY1A (0.58) | SHBGAMY1ACYP2C9CYP2C19HIF1A | |
| SCHEMBL30375265 | 0.88 | AMY1A (0.58) | SHBGAMY1ACYP2C9CYP2C19HIF1A | |
| SCHEMBL16081299 | 0.86 | ESR1 (0.56) | SHBGAMY1ACYP2C9CYP2C19HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| JP-9291056-A | — | — | None | — | — | JP | disclosed |
| JP-H09291056-A | PENTAPHENOL-BASED COMPOUND AND ITS USE | SUMITOMO CHEM CO LTD | 1997-11-11 | — | — | JP | disclosed |