Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 3/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CLK1 | P49759 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 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 | |
|---|---|---|---|---|
| SCHEMBL11589180 | 0.82 | ADORA1 (0.58) | ADORA1ADORA2AKDM4EKMT2ACA5A | |
| SCHEMBL1272672 | 0.79 | ADORA2A (0.45) | ADORA1ADORA2AKDM4EKMT2AALDH1A1 | |
| SCHEMBL11592378 | 0.71 | ADORA1 (0.53) | ADORA1ADORA2AKDM4EKMT2ACA5A | |
| SCHEMBL8324129 | 0.70 | ADORA1 (0.54) | ADORA1ADORA2AKDM4EKMT2ACA5A | |
| SCHEMBL7978388 | 0.68 | ADORA1 (0.61) | ADORA1ADORA2AKDM4EKMT2ACA5A | |
| SCHEMBL5369123 | 0.66 | KDM4E (0.50) | ADORA1ADORA2AKDM4EKMT2AALDH1A1 | |
| SCHEMBL11591825 | 0.62 | KDM4E (0.58) | ADORA1ADORA2AKDM4EKMT2AALDH1A1 | |
| SCHEMBL14879331 | 0.61 | ADORA1 (0.65) | ADORA1ADORA2AKDM4ECA5ALMNA | |
| SCHEMBL3358664 | 0.61 | AURKA (0.54) | ADORA1ADORA2AKDM4EKMT2AALDH1A1 | |
| SCHEMBL11591796 | 0.61 | ADORA1 (0.53) | ADORA1ADORA2AKDM4EKMT2ACA5A |
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-4103257-A | BLUE TO NEAR ULTRAVIOLET | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) | 1978-07-25 | — | — | US | disclosed |