Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | OPRM1 | P35372 | 14/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 14/20 | 0.43 |
| ▸ | OPRL1 | P41146 | 13/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 12/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL319470 | 0.83 | HSD17B10 (0.68) | HSD17B10OPRM1OPRK1OPRL1OPRD1 | |
| SCHEMBL318959 | 0.81 | HSD17B10 (0.73) | HSD17B10OPRM1OPRK1OPRL1OPRD1 | |
| SCHEMBL3068674 | 0.78 | HSD17B10 (0.73) | HSD17B10OPRM1OPRK1OPRL1OPRD1 | |
| SCHEMBL5556794 | 0.78 | HSD17B10 (0.73) | HSD17B10OPRM1OPRK1OPRL1OPRD1 | |
| SCHEMBL11880961 | 0.78 | HSD17B10 (0.73) | HSD17B10OPRM1OPRK1OPRL1OPRD1 | |
| SCHEMBL11593274 | 0.78 | HSD17B10 (0.73) | HSD17B10OPRM1OPRK1OPRL1OPRD1 | |
| SCHEMBL219618 | 0.78 | HSD17B10 (1.00) | HSD17B10OPRM1OPRK1OPRL1OPRD1 | |
| SCHEMBL7587764 | 0.78 | HSD17B10 (1.00) | HSD17B10OPRM1OPRK1OPRL1OPRD1 | |
| Hydrochloric Acid SCHEMBL6160546 | 0.76 | HSD17B10 (0.97) | HSD17B10OPRM1OPRK1OPRL1OPRD1 | |
| Ammonia Solution, Strong SCHEMBL1764035 | 0.76 | HSD17B10 (0.97) | HSD17B10OPRM1OPRK1OPRL1OPRD1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3092228-A1 | TRPA1 MODULATORS | Algomedix, Inc. (US) | 2016-11-16 | — | — | EP | disclosed |
| WO-2015103060-A1 | TRPA1 MODULATORS | ALGOMEDIX, INC. (US) | 2015-07-09 | — | — | WO | disclosed |