Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | FAP | Q12884 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8935170 | 0.98 | HTT (0.52) | HTTSLC7A5GRIN2DGRIN3BGRIN1 | |
| SCHEMBL19236549 | 0.83 | HTT (0.58) | HTTGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL26231100 | 0.83 | SLC7A5 (0.42) | HTTSLC7A5GRIN2DGRIN3BGRIN1 | |
| Hydrochloric Acid SCHEMBL8935168 | 0.81 | HTT (0.47) | HTTDPP4DPP8DPP9DPP7 | |
| SCHEMBL721376 | 0.81 | SLC7A5 (0.41) | HTTSLC7A5GRIN2DGRIN3BGRIN1 | |
| SCHEMBL721378 | 0.81 | SLC7A5 (0.41) | HTTSLC7A5GRIN2DGRIN3BGRIN1 | |
| Hydrochloric Acid SCHEMBL19209738 | 0.81 | HTT (0.56) | HTTGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL1933773 | 0.79 | SLC7A5 (0.39) | HTTSLC7A5GRIN2DGRIN3BGRIN1 | |
| SCHEMBL19581794 | 0.79 | SLC7A5 (0.39) | HTTSLC7A5GRIN2DGRIN3BGRIN1 | |
| SCHEMBL19581789 | 0.79 | SLC7A5 (0.39) | HTTSLC7A5GRIN2DGRIN3BGRIN1 |
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-6794492-B2 | N-(2,2,2-TRIFLUOROETHYL)GLYCINE DERIVATIVES; CAN BE USED TO PREPARE LIPOPHILIC PROTEINS ADAPTED FOR CROSSING THE BLOOD BRAIN BARRIER | CLEMSON UNIVERSITY | 2004-09-21 | — | — | US | claimed |