Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.50 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.47 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | NCF1 | P14598 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MBTD1 | Q05BQ5 | 2/20 | 0.43 |
| ▸ | L3MBTL3 | Q96JM7 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27729240 | 0.98 | HRH3 (0.53) | HRH3PRMT6CHRNB2CHRNA4ALDH1A1 | |
| SCHEMBL845155 | 0.98 | HRH3 (0.52) | HRH3PRMT6CHRNB2CHRNA4ALDH1A1 | |
| SCHEMBL161004 | 0.96 | HRH3 (0.55) | HRH3PRMT6CHRNB2CHRNA4ALDH1A1 | |
| SCHEMBL23113743 | 0.94 | HRH3 (0.47) | HRH3PRMT6CHRNB2CHRNA4ALDH1A1 | |
| SCHEMBL27724955 | 0.91 | SMN1; SMN2 (0.46) | HRH3PRMT6CHRNB2CHRNA4ALDH1A1 | |
| SCHEMBL27801847 | 0.90 | SMN1; SMN2 (0.49) | HRH3PRMT6CHRNB2CHRNA4ALDH1A1 | |
| SCHEMBL27729376 | 0.84 | HRH3 (0.51) | HRH3ALDH1A1SMN1; SMN2SIGMAR1NCF1 | |
| SCHEMBL61472 | 0.82 | MC4R (0.62) | PRMT6ALDH1A1HRH4SIGMAR1NCF1 | |
| SCHEMBL62595 | 0.82 | HRH3 (0.53) | HRH3ALDH1A1SMN1; SMN2SIGMAR1NCF1 | |
| SCHEMBL2476102 | 0.82 | SIGMAR1 (0.62) | HRH3ALDH1A1TDP1CYP2C19SIGMAR1 |
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-101228180-B | Tripeptides as hepatitis C virus inhibitors | BRISTOL MYERS SQUIBB CO | 2011-03-09 | — | — | CN | disclosed |
| CN-101228180-A | Tripeptides as hepatitis C virus inhibitors | BRISTOL MYERS SQUIBB CO (US) | 2008-07-23 | — | — | CN | disclosed |