Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | TNF | P01375 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | CCR6 | P51684 | 1/20 | 0.34 |
| ▸ | RUNX1 | Q01196 | 1/20 | 0.34 |
| ▸ | CBFB | Q13951 | 1/20 | 0.34 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.34 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.34 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.34 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9502321 | 1.00 | ADORA2A (0.39) | ADORA2AKDM4ENPSR1ALDH1A1HPGD | |
| SCHEMBL9503006 | 0.92 | ADORA2A (0.38) | ADORA2AKDM4ENPSR1ALDH1A1HPGD | |
| SCHEMBL9503001 | 0.92 | ADORA2A (0.38) | ADORA2AKDM4ENPSR1ALDH1A1HPGD | |
| SCHEMBL9501713 | 0.91 | ADORA2A (0.39) | ADORA2AKDM4ENPSR1ALDH1A1MAPT | |
| SCHEMBL9501720 | 0.91 | ADORA2A (0.39) | ADORA2AKDM4ENPSR1ALDH1A1MAPT | |
| SCHEMBL9504296 | 0.91 | ADORA2A (0.41) | ADORA2AKDM4ENPSR1ALDH1A1HPGD | |
| SCHEMBL9504289 | 0.91 | ADORA2A (0.41) | ADORA2AKDM4ENPSR1ALDH1A1HPGD | |
| SCHEMBL9505322 | 0.89 | ADORA2A (0.40) | ADORA2AKDM4ENPSR1ALDH1A1HPGD | |
| SCHEMBL9505318 | 0.89 | ADORA2A (0.40) | ADORA2AKDM4ENPSR1ALDH1A1HPGD | |
| SCHEMBL10580658 | 0.85 | ADORA2A (0.39) | ADORA2AKDM4ENPSR1ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0307866-B1 | DICHROIC COLORING AGENTS FOR LIQUID CRYSTAL DISPLAYS | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1993-05-12 | — | — | EP | disclosed |
| US-4883611-A | ANTHRAQUINONE COMPOUND CONTAINING DECAHYDRONAPHTHYL GROUP | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1989-11-28 | — | — | US | disclosed |