Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.40 |
| ▸ | MRGPRX2 | Q96LB1 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28314443 | 0.96 | SMN1; SMN2 (0.50) | SMN1; SMN2HIF1ATRPA1CYP1A2CYP2D6 | |
| SCHEMBL21269478 | 0.96 | SMN1; SMN2 (0.50) | SMN1; SMN2HIF1ATRPA1CYP1A2CYP2D6 | |
| SCHEMBL21269521 | 0.96 | SMN1; SMN2 (0.50) | SMN1; SMN2HIF1ATRPA1CYP1A2CYP2D6 | |
| SCHEMBL21269477 | 0.96 | SMN1; SMN2 (0.50) | SMN1; SMN2HIF1ATRPA1CYP1A2CYP2D6 | |
| SCHEMBL28315549 | 0.96 | SMN1; SMN2 (0.50) | SMN1; SMN2HIF1ATRPA1CYP1A2CYP2D6 | |
| SCHEMBL28314546 | 0.94 | SMN1; SMN2 (0.48) | SMN1; SMN2HIF1ATRPA1CYP1A2CYP2D6 | |
| SCHEMBL28314666 | 0.94 | SMN1; SMN2 (0.48) | SMN1; SMN2HIF1ATRPA1CYP1A2CYP2D6 | |
| SCHEMBL28314702 | 0.94 | SMN1; SMN2 (0.48) | SMN1; SMN2HIF1ATRPA1CYP1A2CYP2D6 | |
| SCHEMBL9358974 | 0.84 | SMN1; SMN2 (0.43) | SMN1; SMN2HIF1ATRPA1CYP1A2CYP2D6 | |
| SCHEMBL8999081 | 0.83 | HPGD (0.41) | SMN1; SMN2CYP1A2CYP2D6PPARGPPARA |
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-110172019-A | The metal salt of malonic acid as the nucleating additive for crystalline thermoplastic | 印度石油有限公司 | 2019-08-27 | — | — | CN | disclosed |