Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 4/20 | 0.56 |
| ▸ | ATP4A | P20648 | 1/20 | 0.43 |
| ▸ | ATP4B | P51164 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | PHGDH | O43175 | 3/20 | 0.41 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.41 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6511300 | 0.77 | ADORA2A (0.64) | ADORA2AATP4AATP4BALDH1A1HTT | |
| SCHEMBL5923332 | 0.77 | EPHX2 (0.49) | ALDH1A1LMNAKMT2AKDM4EPHGDH | |
| SCHEMBL6510332 | 0.76 | KMT2A (0.55) | ATP4AATP4BALDH1A1KMT2APHGDH | |
| SCHEMBL2801062 | 0.74 | ADORA2A (0.73) | ADORA2AATP4AATP4BALDH1A1LMNA | |
| SCHEMBL6507381 | 0.73 | RAB9A (0.54) | ADORA2AATP4AATP4BLMNAKMT2A | |
| SCHEMBL6514076 | 0.72 | ADORA2A (0.52) | ADORA2AATP4AATP4BALDH1A1HTT | |
| SCHEMBL5923207 | 0.71 | SMN1; SMN2 (0.52) | ALDH1A1HTTLMNAKMT2AKDM4E | |
| SCHEMBL6518566 | 0.70 | CYP1A2 (0.56) | ALDH1A1LMNAKMT2AKDM4EPHGDH | |
| SCHEMBL6510602 | 0.70 | MAPK1 (0.63) | LMNAKMT2AKDM4EPHGDHSCN2A | |
| SCHEMBL6508975 | 0.69 | MEN1 (0.53) | ALDH1A1HTTLMNAKMT2ASMN1; SMN2 |
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-2005095345-A2 | HETEROARYL GUANIDINES AS INHIBITORS OF VIRAL REPLICATION | ACHILLION PHARMACEUTICALS, INC. (US) | 2005-10-13 | — | — | WO | claimed |