Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 4/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 7/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27633503 | 0.92 | CHEK1 (0.37) | CHRNB4CHRNA3CHRNB2CHRNA4CHEK1 | |
| SCHEMBL2876967 | 0.85 | KDM4E (0.46) | CHRNB4CHRNA3CHRNB2CHRNA4KDM4E | |
| SCHEMBL2870751 | 0.77 | KDM4E (0.47) | KDM4EHTTATMMAPTALDH1A1 | |
| SCHEMBL2877042 | 0.76 | NR1I2 (0.41) | CHRNB4CHRNA3CHRNB2CHRNA4KDM4E | |
| SCHEMBL14136979 | 0.76 | KDM4E (0.48) | KDM4EHTTATMMAPTALDH1A1 | |
| SCHEMBL14049088 | 0.76 | CHEK1 (0.42) | CHRNB4CHRNA3CHRNB2CHRNA4CHEK1 | |
| Hydrochloric Acid SCHEMBL2878280 | 0.76 | NR1I2 (0.41) | CHRNB4CHRNA3CHRNB2CHRNA4KDM4E | |
| SCHEMBL2879441 | 0.71 | KDM4E (0.55) | CHRNB4CHRNA3CHRNB2CHRNA4KDM4E | |
| SCHEMBL14031010 | 0.69 | NR1I2 (0.40) | CHEK1ALDH1A1CHRM3CHRM5CHRM1 | |
| SCHEMBL2879579 | 0.69 | SMN1; SMN2 (0.44) | KDM4EHTTATM |
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 |
|---|---|---|---|---|---|---|---|
| CN-100413861-C | Compounds and methods for the treatment or prevention of flavivirus infections | VIROCHEM PHARMA INC (CA) | 2008-08-27 | — | — | CN | disclosed |
| CN-1795190-A | Compounds and methods for the treatment or prevention of flavivirus infections | VIROCHEM PHARMA INC (CA) | 2006-06-28 | — | — | CN | disclosed |