Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CASP1 | P29466 | 3/20 | 0.42 |
| ▸ | CASP7 | P55210 | 3/20 | 0.42 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.40 |
| ▸ | PDE5A | O76074 | 1/20 | 0.40 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | IKBKB | O14920 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2368984 | 0.81 | FGFR1 (0.41) | CYP1A2ALDH1A1HSD17B10TSHRCLK4 | |
| SCHEMBL6356763 | 0.81 | SQOR (0.37) | CYP1A2ALDH1A1HSD17B10CYP2C9CYP3A4 | |
| SCHEMBL6359949 | 0.77 | SQOR (0.37) | ALDH1A1CLK4PDE5ASQORESR1 | |
| SCHEMBL2368935 | 0.75 | ALDH1A1 (0.44) | CYP1A2ALDH1A1HSD17B10TSHRCLK4 | |
| SCHEMBL30341183 | 0.74 | NPC1 (0.47) | CYP1A2ALDH1A1CYP2C9CYP2C19CLK4 | |
| SCHEMBL2368300 | 0.73 | ESR1 (0.47) | CYP1A2ALDH1A1HSD17B10CYP2C9CYP2C19 | |
| SCHEMBL14965210 | 0.73 | ADORA1 (0.50) | ALDH1A1CLK4DAPK3PRKD3MAP4K4 | |
| SCHEMBL30341175 | 0.73 | ALDH1A1 (0.46) | CYP1A2ALDH1A1TSHRCLK4HPGD | |
| SCHEMBL6358684 | 0.72 | LMNA (0.40) | ALDH1A1HSD17B10TSHRCLK4MAPK1 | |
| SCHEMBL2368759 | 0.71 | BTK (0.39) | ALDH1A1HSD17B10CASP7TSHRCLK4 |
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-8022076-B2 | Thieno[2,3-d]pyrimidine derivatives as potassium channel modulators; antiarrhythmia agents | XENTION LIMITED (GB) | 2011-09-20 | — | — | US | disclosed |