Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 6/20 | 0.69 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.69 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.60 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.60 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.56 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CA7 | P43166 | 1/20 | 0.55 |
| ▸ | CA9 | Q16790 | 1/20 | 0.55 |
| ▸ | HTR1A | P08908 | 1/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.55 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.55 |
| ▸ | HTR1D | P28221 | 1/20 | 0.55 |
| ▸ | HTR2A | P28223 | 1/20 | 0.55 |
| ▸ | HTR2C | P28335 | 1/20 | 0.55 |
| ▸ | HTR7 | P34969 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL19417246 | 0.83 | ADORA2A (0.91) | ADORA1ADORA2ACYP1A1CYP1B1HRH4 | |
| SCHEMBL4904514 | 0.83 | ADORA2A (1.00) | ADORA1ADORA2ACYP1A1CYP1B1HRH4 | |
| SCHEMBL19862133 | 0.83 | GABRA1 (0.54) | ADORA1ADORA2AKDM4EGABRA1GABRG2 | |
| SCHEMBL15308225 | 0.83 | L3MBTL1 (0.69) | ADORA1ADORA2AKDM4EGABRA1GABRG2 | |
| SCHEMBL23383854 | 0.83 | ABCG2 (0.64) | ADORA1ADORA2AKDM4EGABRA1GABRG2 | |
| SCHEMBL23383851 | 0.83 | ABCG2 (0.64) | ADORA1ADORA2AKDM4EGABRA1GABRG2 | |
| SCHEMBL17051424 | 0.81 | GABRA1 (0.56) | ADORA1ADORA2AKDM4EGABRA1GABRG2 | |
| SCHEMBL19164377 | 0.81 | GABRA1 (0.56) | ADORA1ADORA2AKDM4EGABRA1GABRG2 | |
| SCHEMBL22814503 | 0.81 | ABCG2 (0.62) | ADORA1ADORA2AKDM4EGABRA1GABRG2 | |
| SCHEMBL19920851 | 0.81 | MYC (0.59) | ADORA1ADORA2AKDM4EGABRA1GABRG2 |
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-RE46974-E1 | Organic electroluminescence device | IDEMITSU KOSAN CO., LTD. (JP) | 2018-07-31 | — | — | US | disclosed |