Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | MGLL | Q99685 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.46 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CASP6 | P55212 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12374349 | 0.87 | ALDH1A1 (0.42) | HSP90AA1MGLLCACNA1BAPBA1HSD17B10 | |
| SCHEMBL16945821 | 0.86 | HSP90AA1 (0.49) | HSP90AA1MGLLL3MBTL1CACNA1BAPBA1 | |
| SCHEMBL19422234 | 0.85 | HSP90AA1 (0.39) | HSP90AA1MGLLL3MBTL1CACNA1BAPBA1 | |
| SCHEMBL12374353 | 0.83 | ELANE (0.43) | MGLLCACNA1BAPBA1MAPTHSD17B10 | |
| SCHEMBL13203012 | 0.83 | P2RX4 (0.43) | MAPTHSD17B10ALDH1A1 | |
| SCHEMBL13752329 | 0.81 | P2RX4 (0.44) | MAPTHSD17B10ALDH1A1 | |
| SCHEMBL12433648 | 0.80 | CYP2A6 (0.48) | HSP90AA1MAPTHSD17B10CYP3A4CYP2C9 | |
| SCHEMBL16327689 | 0.79 | AHR (0.43) | HSD17B10ALDH1A1MAPK1 | |
| SCHEMBL12433699 | 0.79 | ELANE (0.43) | L3MBTL1MAPTHSD17B10CYP3A4CYP2D6 | |
| SCHEMBL12620234 | 0.79 | CREBBP (0.33) | HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-9269905-B2 | Polymer compound having carbon cluster structure and organic device using same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2016-02-23 | — | — | US | disclosed |
| US-20130270545-A1 | POLYMER COMPOUND HAVING CARBON CLUSTER STRUCTURE AND ORGANIC DEVICE USING SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-10-17 | — | — | US | disclosed |