Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.59 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.46 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.46 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL16418454 | 0.93 | ESR1 (0.66) | ESR1L3MBTL1CHRNB4CHRNA3CHRNA7 | |
| Bromide SCHEMBL16414995 | 0.91 | ESR1 (0.64) | ESR1L3MBTL1CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL16800108 | 0.81 | ESR1 (0.57) | ESR1NPC1DRD2DRD4DRD3 | |
| SCHEMBL12013797 | 0.81 | DRD2 (0.55) | L3MBTL1CHRNB4CHRNA3CHRNA7CHRNA10 | |
| SCHEMBL18135627 | 0.80 | NPC1 (0.50) | ESR1NPC1L3MBTL1DRD2DRD4 | |
| SCHEMBL862518 | 0.77 | TP53 (0.63) | NPC1 | |
| SCHEMBL16418450 | 0.77 | GAA (0.51) | NPC1L3MBTL1DRD2DRD4DRD3 | |
| SCHEMBL10153479 | 0.77 | TP53 (0.63) | NPC1 | |
| SCHEMBL80066 | 0.76 | CHRNA7 (0.65) | ESR1CHRNB4CHRNA3CHRNA7CHRNA10 | |
| SCHEMBL3152156 | 0.76 | PKM (0.65) | ESR1L3MBTL1 |
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-20160299078-A1 | Specific Detection and Quantification of Cardiolipin and Isolated Mitochondria by Positively Charged AIE Fluorogens and Method of Manufacturing Thereof | THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) | 2016-10-13 | — | — | US | disclosed |