Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 6/20 | 0.37 |
| ▸ | PIK3R1 | P27986 | 6/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 5/20 | 0.37 |
| ▸ | PIK3CB | P42338 | 5/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 4/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.35 |
| ▸ | CDK2 | P24941 | 3/20 | 0.35 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.35 |
| ▸ | MAPK9 | P45984 | 3/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL30108027 | 0.92 | TSHR (0.39) | TSHRSMN1; SMN2RAB9AKDM4EALDH1A1 | |
| SCHEMBL30107988 | 0.86 | TSHR (0.33) | TSHRSMN1; SMN2KDM4EMAPK14CDK2 | |
| SCHEMBL30108003 | 0.84 | MET (0.40) | ALDH1A1MAPTHRH4 | |
| SCHEMBL30108012 | 0.72 | TSHR (0.58) | TSHRSMN1; SMN2RAB9AKDM4EALDH1A1 | |
| SCHEMBL30107965 | 0.72 | MET (0.40) | TSHRSMN1; SMN2RAB9AKDM4EALDH1A1 | |
| SCHEMBL29544252 | 0.65 | RAB9A (0.58) | TSHRSMN1; SMN2RAB9AKDM4EALDH1A1 | |
| SCHEMBL28563917 | 0.65 | RAB9A (0.58) | TSHRSMN1; SMN2RAB9AKDM4EALDH1A1 | |
| SCHEMBL15780431 | 0.64 | RAB9A (0.57) | TSHRSMN1; SMN2RAB9AKDM4EALDH1A1 | |
| SCHEMBL20156597 | 0.64 | RAB9A (0.61) | TSHRSMN1; SMN2RAB9AKDM4EALDH1A1 | |
| SCHEMBL10103846 | 0.63 | RAB9A (0.59) | TSHRSMN1; SMN2RAB9AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022203399-A1 | ADENOSINE A2A RECEPTOR ANTAGONIST AND USE THEREOF | 주식회사 스탠다임 | 2022-09-29 | — | — | WO | disclosed |