Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | MC4R | P32245 | 2/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | CACNA1G | O43497 | 6/20 | 0.53 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | HTR2B | P41595 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL15149552 | 1.00 | HPGD (0.56) | HPGDMC4RUSP2ALDH1A1CACNA1G | |
| SCHEMBL19245541 | 0.81 | HPGD (0.52) | HPGDMC4RUSP2ALDH1A1CACNA1G | |
| SCHEMBL19245402 | 0.80 | HPGD (0.51) | HPGDMC4RUSP2ALDH1A1CACNA1G | |
| SCHEMBL21262164 | 0.78 | ALDH1A1 (0.49) | HPGDMC4RUSP2ALDH1A1CACNA1G | |
| SCHEMBL172539 | 0.77 | MC4R (0.58) | HPGDMC4RUSP2ALDH1A1CACNA1G | |
| SCHEMBL6685347 | 0.77 | MC4R (0.58) | HPGDMC4RUSP2ALDH1A1CACNA1G | |
| SCHEMBL9356279 | 0.76 | MC4R (0.56) | HPGDMC4RUSP2ALDH1A1CACNA1G | |
| SCHEMBL5154669 | 0.76 | HTR2C (0.77) | HPGDMC4RUSP2ALDH1A1CACNA1G | |
| SCHEMBL1789145 | 0.76 | HTR2C (0.77) | HPGDMC4RUSP2ALDH1A1CACNA1G | |
| SCHEMBL9356274 | 0.76 | MC4R (0.56) | HPGDMC4RUSP2ALDH1A1CACNA1G |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017177979-A1 | HETEROCYCLIC CARBOXYLIC ACID AMIDE LIGAND AND APPLICATIONS THEREOF IN COPPER CATALYZED COUPLING REACTION OF ARYL HALOGENO SUBSTITUTE | 中国科学院上海有机化学研究所 | 2017-10-19 | — | — | WO | disclosed |