Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 4/20 | 0.35 |
| ▸ | CA2 | P00918 | 4/20 | 0.35 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | MPO | P05164 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11377017 | 0.76 | FOLH1 (0.41) | TSHRHIF1AKDM4E | |
| 2-Allylphenol SCHEMBL28054215 | 0.76 | IDO1 (0.52) | IDO1HSPA5HTR1ATAAR1AKR1B1 | |
| SCHEMBL25620316 | 0.75 | HSPA5 (0.52) | IDO1HSPA5TSHRCYP2D6HIF1A | |
| SCHEMBL7952963 | 0.74 | MAOB (0.43) | IDO1TSHRCA2HSD17B10 | |
| 2-Allylphenol SCHEMBL28374590 | 0.74 | GABRA1 (0.46) | IDO1HSPA5HTR1ATSHRCYP2D6 | |
| 2-Allylphenol SCHEMBL184203 | 0.74 | GABRA1 (0.46) | IDO1HSPA5HTR1ATSHRCYP2D6 | |
| SCHEMBL7012686 | 0.74 | HSPA5 (0.50) | IDO1HSPA5TSHRCYP2D6HIF1A | |
| 2-Allylphenol SCHEMBL170457 | 0.72 | GABRA1 (0.44) | IDO1HSPA5HTR1ATSHRCYP2D6 | |
| 2-Allylphenol SCHEMBL9771506 | 0.72 | GABRA1 (0.44) | IDO1HSPA5HTR1AAKR1B1KDM4E | |
| 2-Allylphenol SCHEMBL10583297 | 0.72 | GABRA1 (0.44) | IDO1HSPA5HTR1ATSHRCYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104884442-B | Terazololine-one compound and application thereof | 住友化学株式会社 | 2016-11-02 | — | — | CN | disclosed |