Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1293884 | 0.83 | ALDH1A1 (0.46) | ALDH1A1NPC1RAB9AMAPTMEN1 | |
| SCHEMBL21865086 | 0.83 | ALDH1A1 (0.47) | ALDH1A1NPC1RAB9AMAPTMEN1 | |
| SCHEMBL14914575 | 0.71 | ALDH1A1 (0.39) | ALDH1A1NPC1RAB9AMAPTMEN1 | |
| SCHEMBL12648089 | 0.71 | ALDH1A1 (0.40) | ALDH1A1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL10253926 | 0.69 | POLB (0.32) | CYP1A2 | |
| SCHEMBL21865083 | 0.68 | ALDH1A1 (0.48) | ALDH1A1NPC1RAB9AMAPTMEN1 | |
| SCHEMBL24196323 | 0.67 | DGAT1 (0.39) | ALDH1A1NPC1RAB9AMAPTMEN1 | |
| SCHEMBL2000194 | 0.67 | ALDH1A1 (0.62) | ALDH1A1NPC1RAB9AMAPTMEN1 | |
| SCHEMBL1209894 | 0.67 | GABRA2 (0.52) | ALDH1A1NPC1RAB9AMAPTMEN1 | |
| SCHEMBL1209743 | 0.67 | ALDH1A1 (0.47) | ALDH1A1NPC1RAB9AMAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011059887-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-05-19 | — | — | WO | disclosed |
| WO-2011059850-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-05-19 | — | — | WO | disclosed |