Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 6/20 | 0.32 |
| ▸ | CA9 | Q16790 | 6/20 | 0.32 |
| ▸ | CA12 | O43570 | 5/20 | 0.32 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 4/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CA3 | P07451 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA6 | P23280 | 1/20 | 0.31 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.31 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| Tetraphenylphosphonium SCHEMBL11324663 | 0.86 | HTR6 (0.33) | HTR6CA2CA9CA12SOS1 | |
| Tetraphenylphosphonium SCHEMBL3821606 | 0.85 | HTR6 (0.39) | HTR6CA2CA9CA12CA1 | |
| SCHEMBL11325583 | 0.84 | TSHR (0.41) | CA2CA9CA12CA1TSHR | |
| Tetraphenylphosphonium SCHEMBL1271289 | 0.83 | HTR6 (0.38) | HTR6CA2CA9CA12CA1 | |
| Tetraphenylphosphonium SCHEMBL19615045 | 0.81 | KEAP1 (0.39) | HTR6CA2CA9CA12HIF1A | |
| Tetraphenylphosphonium SCHEMBL1271290 | 0.81 | TSHR (0.44) | HTR6CA2CA9CA12CA1 | |
| SCHEMBL30892253 | 0.77 | SNCA (0.47) | CA2CA9CA1HIF1AALDH1A1 | |
| Tetraphenylphosphonium SCHEMBL21957774 | 0.76 | GPR3 (0.50) | CA2CA9CA1CA5APTPN1 | |
| Tetraphenylphosphonium SCHEMBL4930284 | 0.74 | PTGS2 (0.47) | CA2CA9CA1HIF1A | |
| Tetraphenylphosphonium SCHEMBL29362652 | 0.74 | HIF1A (0.50) | CA2CA9CA12CA1HIF1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8796474-B1 | Macrolide compounds and methods and intermediates useful for their preparation | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2014-08-05 | — | — | US | disclosed |
| US-8796269-B2 | Crystalline 2-(3,5-Bis(trifluoromethyl)phenyl)-N-(4-(4-fluoro-2-methylphenyl)-6-((7S,9aS)-7-(hydroxymethyl)hexahydropyrazino[2,1-c][1,4]oxazin-8(1H)-yl)pyridin-3-yl)-N,2-dimethyl-propanamide of the formula (I), their use in therapy, and process for the preparation of the same | NERRE THERAPEUTICS LIMITED (GB) | 2014-08-05 | — | — | US | disclosed |
| WO-2005056543-A2 | PROCESS FOR USE IN THE PREPARATION OF OXIRANES FROM ALKENES, AND CATALYSTS FOR USE THEREIN | AVECIA PHARMACEUTICALS LIMITED (GB) | 2005-06-23 | — | — | WO | disclosed |
| US-4247620-A | TETRAARYL PHOSPHONIUM, AMMONIUM OR ARSONIUM METAL POLYCARBOXYLATES | KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) | 1981-01-27 | — | — | US | disclosed |