Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | BCL9 | O00512 | 4/20 | 0.37 |
| ▸ | CTNNB1 | P35222 | 4/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.37 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14030802 | 0.93 | ACKR3 (0.38) | HTTACKR3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL2879579 | 0.91 | SMN1; SMN2 (0.44) | HTTKDM4EATMNPC1RAB9A | |
| SCHEMBL2876967 | 0.88 | KDM4E (0.46) | HTTKDM4EATMCHRNB2CHRNA4 | |
| SCHEMBL6426855 | 0.84 | SMN1; SMN2 (0.45) | HTTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL14030873 | 0.83 | SMN1; SMN2 (0.43) | HTTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL2746312 | 0.82 | SMN1; SMN2 (0.45) | HTTKDM4EATMNPC1RAB9A | |
| SCHEMBL14136980 | 0.80 | SMN1; SMN2 (0.44) | HTTKDM4EATMNPC1RAB9A | |
| SCHEMBL2877042 | 0.80 | NR1I2 (0.41) | HTTKDM4EATMCHRNB2CHRNA4 | |
| SCHEMBL12464666 | 0.80 | SMN1; SMN2 (0.45) | HTTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL2877282 | 0.78 | ACKR3 (0.49) | HTTKDM4EATMACKR3NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1569929-B9 | COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS | VIROCHEM PHARMA INC (CA) | 2011-09-14 | — | — | EP | claimed |
| EP-1569929-B1 | COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS | VIROCHEM PHARMA INC (CA) | 2010-05-05 | — | — | EP | claimed |