Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CPA1 | P15085 | 6/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.38 |
| ▸ | DRD3 | P35462 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7512192 | 0.81 | CHRM2 (0.33) | CHRM2CHRM1CHRM3CYP1A2CPA1 | |
| SCHEMBL27735789 | 0.78 | CYP1A2 (0.41) | CYP1A2CPA1ALDH1A1TSHRCYP2C19 | |
| SCHEMBL8331186 | 0.76 | CYP19A1 (0.42) | CYP1A2CPA1ALDH1A1CYP2C19HIF1A | |
| SCHEMBL28094845 | 0.75 | TSHR (0.45) | CYP1A2CPA1ALDH1A1TSHRCYP2C19 | |
| SCHEMBL1348079 | 0.73 | CYP19A1 (0.37) | CYP1A2CPA1ALDH1A1CYP2C19HIF1A | |
| SCHEMBL28052003 | 0.73 | CYP1A2 (0.41) | CYP1A2CPA1ALDH1A1TSHRCYP2C19 | |
| SCHEMBL26929273 | 0.73 | CYP2C19 (0.44) | ALDH1A1CYP2C19HIF1ALMNA | |
| SCHEMBL6384616 | 0.73 | CYP1A2 (0.48) | CHRM2CHRM1CHRM3CYP1A2ALDH1A1 | |
| SCHEMBL9768400 | 0.72 | CYP2C19 (0.48) | CPA1ALDH1A1CYP2C19HIF1ALMNA | |
| SCHEMBL8977864 | 0.72 | ALDH1A1 (0.38) | CYP1A2CPA1ALDH1A1TSHRCYP2C19 |
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-20040014161-A1 | pH-indicator based assay for selective enzymes | THERMOGEN, INC. | 2004-01-22 | — | — | US | disclosed |