Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 2/20 | 0.38 |
| ▸ | EDNRB | P24530 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2404932 | 0.81 | EDNRA (0.40) | EDNRAEDNRBATMGRM1GRM2 | |
| SCHEMBL2400874 | 0.77 | EDNRA (0.37) | EDNRAEDNRBCYP2C9ATMLMNA | |
| SCHEMBL30522434 | 0.77 | EDNRA (0.37) | EDNRAEDNRBATMLMNAALDH1A1 | |
| SCHEMBL2405982 | 0.77 | MAPT (0.44) | EDNRAEDNRBCYP2C9LMNAALDH1A1 | |
| SCHEMBL8797292 | 0.75 | HTR2A (0.43) | EDNRAEDNRBCYP2C9ATMLMNA | |
| SCHEMBL15104959 | 0.74 | EDNRA (0.36) | EDNRAEDNRBCYP2C9LMNAALDH1A1 | |
| SCHEMBL27925789 | 0.73 | EDNRA (0.35) | EDNRAEDNRBCYP2C9ATMLMNA | |
| SCHEMBL29508252 | 0.73 | TSHR (0.36) | EDNRAEDNRBLMNAALDH1A1HDAC4 | |
| SCHEMBL5404798 | 0.72 | EDNRA (0.34) | EDNRAEDNRBLMNAALDH1A1MEN1 | |
| SCHEMBL31213694 | 0.72 | EDNRA (0.34) | EDNRAEDNRBLMNAALDH1A1MEN1 |
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-104072486-A | BI-1H-BENZIMIDAZOLES AS HEPATITIS C VIRUS INHIBITORS | BRISTOL MYERS SQUIBB CO | 2014-10-01 | — | — | CN | disclosed |
| CN-102177141-B | bis-1H-benzimidazoles as hepatitis C virus inhibitors | BRISTOL MYERS SQUIBB CO | 2014-07-23 | — | — | CN | disclosed |