Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8605901 | 0.83 | CHRNB4 (0.41) | ALDH1A1SMN1; SMN2RAB9AHPGDNPC1 | |
| SCHEMBL25620287 | 0.73 | SLC6A2 (0.53) | ALDH1A1SMN1; SMN2HTTRAB9ASLC6A2 | |
| SCHEMBL5803767 | 0.72 | ALDH1A1 (0.50) | ALDH1A1ALDH1A3SLC6A4CYP2A6TAS1R3 | |
| SCHEMBL22411888 | 0.72 | ADH1B (0.32) | — | |
| SCHEMBL25620291 | 0.72 | SLC6A2 (0.55) | ALDH1A1SMN1; SMN2HTTRAB9ANPC1 | |
| SCHEMBL1299966 | 0.70 | ALDH1A3 (0.62) | ALDH1A1SMN1; SMN2RAB9AHPGDNPC1 | |
| SCHEMBL178454 | 0.69 | CA1 (0.61) | ALDH1A1RAB9ANPC1ALDH1A3SLC6A4 | |
| SCHEMBL5512005 | 0.69 | CA1 (0.61) | ALDH1A1RAB9ANPC1SLC6A4KDM4E | |
| SCHEMBL4751285 | 0.67 | ALDH1A1 (0.32) | ALDH1A1SMN1; SMN2HPGDKDM4E | |
| SCHEMBL3891377 | 0.67 | SLC6A2 (0.54) | ALDH1A1SMN1; SMN2HTTRAB9ASLC6A2 |
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-2003095441-A1 | INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE, AND COMPOSITIONS AND TREATMENTS USING THE SAME | PFIZER INC. (US) | 2003-11-20 | — | — | WO | disclosed |