Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | HMGCR | P04035 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | CPT2 | P23786 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.35 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL503894 | 0.80 | CYP2C19 (0.75) | CYP2C19HIF1ACYP2D6TSHRHMGCR | |
| SCHEMBL14867210 | 0.80 | CYP2C19 (0.75) | CYP2C19HIF1ACYP2D6TSHRHMGCR | |
| SCHEMBL1301910 | 0.76 | CYP2C19 (0.54) | CYP2C19HIF1ACYP2D6TSHRHMGCR | |
| SCHEMBL15478866 | 0.74 | TSHR (0.41) | CYP2C19HIF1ACYP2D6TSHRTET2 | |
| SCHEMBL18210872 | 0.74 | CYP2C19 (0.65) | CYP2C19HIF1ACYP2D6TSHRHMGCR | |
| SCHEMBL11964743 | 0.74 | CYP2C19 (0.52) | CYP2C19HIF1ACYP2D6TSHRHMGCR | |
| SCHEMBL1419066 | 0.74 | HMGCR (0.52) | CYP2C19HIF1ACYP2D6TSHRHMGCR | |
| SCHEMBL1335602 | 0.74 | HMGCR (0.52) | CYP2C19HIF1ACYP2D6TSHRHMGCR | |
| SCHEMBL14109353 | 0.72 | HMGCR (0.50) | CYP2C19HIF1ACYP2D6TSHRHMGCR | |
| SCHEMBL14983019 | 0.71 | TSHR (0.48) | CYP2C19HIF1ACYP2D6TSHRHMGCR |
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-20170334778-A1 | GYPSUM SLURRIES WITH LINEAR POLYCARBOXYLATE DISPERSANTS | UNITED STATES GYPSUM COMPANY | 2017-11-23 | — | — | US | disclosed |