Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.42 |
| ▸ | RAB9A | P51151 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | FBP1 | P09467 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.41 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| 2-Mercaptobenzothiazole SCHEMBL28389168 | 0.83 | NPC1 (0.41) | NPC1RAB9AKDM4EL3MBTL1FBP1 | |
| SCHEMBL76778 | 0.82 | ALDH1A1 (0.54) | NPC1RAB9AKDM4EL3MBTL1FBP1 | |
| Hydrochloric Acid SCHEMBL2283945 | 0.80 | ALDH1A1 (0.52) | NPC1RAB9AKDM4EL3MBTL1FBP1 | |
| SCHEMBL10668295 | 0.80 | ALDH1A1 (0.52) | NPC1RAB9AKDM4EL3MBTL1FBP1 | |
| Chlorobenzene SCHEMBL28283079 | 0.75 | FBP1 (0.56) | NPC1RAB9AKDM4EL3MBTL1FBP1 | |
| SCHEMBL27609987 | 0.75 | FBP1 (0.47) | NPC1RAB9AKDM4EL3MBTL1FBP1 | |
| SCHEMBL27462536 | 0.75 | FBP1 (0.47) | NPC1RAB9AKDM4EL3MBTL1FBP1 | |
| Dibenzothiophene SCHEMBL27752806 | 0.74 | GPR3 (0.54) | NPC1RAB9AKDM4EL3MBTL1ALDH1A1 | |
| SCHEMBL28283078 | 0.74 | RAB9A (0.51) | NPC1RAB9AKDM4EL3MBTL1FBP1 | |
| 1,2-Dichlorobenzene SCHEMBL28667109 | 0.73 | TSHR (0.46) | NPC1RAB9AKDM4EL3MBTL1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109071685-B | Terminal-modified conjugated diene polymer, rubber composition, and rubber article | 株式会社普利司通 | 2020-12-01 | — | — | CN | disclosed |
| CN-110753706-A | Catalyst composition, method for producing modified conjugated diene polymer, rubber composition, and tire | 株式会社普利司通 | 2020-02-04 | — | — | CN | disclosed |