Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 8/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.44 |
| ▸ | FYN | P06241 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | CA12 | O43570 | 7/20 | 0.43 |
| ▸ | CA1 | P00915 | 6/20 | 0.43 |
| ▸ | CA9 | Q16790 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14294771 | 0.90 | CYP2D6 (0.57) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL19735717 | 0.85 | CYP2D6 (0.70) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL502378 | 0.85 | CYP2D6 (0.70) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL17327517 | 0.85 | CYP2D6 (0.70) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL24584612 | 0.85 | CYP2D6 (0.70) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL23330709 | 0.85 | CYP2D6 (0.70) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL2723648 | 0.85 | CYP2D6 (0.70) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL77518 | 0.85 | CYP2D6 (0.70) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL20524278 | 0.85 | CYP2D6 (0.70) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL5410915 | 0.85 | CYP2D6 (0.70) | CA2CYP2D6THRBHSD17B10TSHR |
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-20090117600-A1 | Detection of biological molecules by differential partitioning of enzyme substrates and products | QUEEN'S UNIVERSITY AT KINGSTON (CA) | 2009-05-07 | — | — | US | disclosed |