Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | LIPC | P11150 | 1/20 | 0.33 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.33 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.33 |
| ▸ | FES | P07332 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 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 | |
|---|---|---|---|---|
| SCHEMBL4731581 | 0.90 | CYP3A4 (0.43) | L3MBTL1POLBKDM4ENPSR1S1PR1 | |
| SCHEMBL14223516 | 0.76 | NPSR1 (0.50) | NPC1L3MBTL1POLBKDM4ENPSR1 | |
| SCHEMBL14223409 | 0.76 | PDK2 (0.33) | NPC1POLBMCOLN3KDM4ENPSR1 | |
| SCHEMBL14223294 | 0.75 | NPC1 (0.37) | NPC1L3MBTL1KDM4ENPSR1KMT2A | |
| SCHEMBL4731813 | 0.74 | CYP3A4 (0.45) | NPC1POLBKDM4ENPSR1CRHR1 | |
| SCHEMBL4730791 | 0.74 | NPC1 (0.35) | NPC1POLBMCOLN3KDM4ENPSR1 | |
| SCHEMBL1961753 | 0.73 | CYP3A4 (0.38) | KDM4ES1PR1CRHR1KMT2ACYP3A4 | |
| SCHEMBL671182 | 0.71 | ALDH1A1 (0.41) | POLBKDM4ECRHR1KMT2A | |
| SCHEMBL4344584 | 0.71 | ALDH1A1 (0.41) | POLBKDM4ECRHR1KMT2A | |
| SCHEMBL14291140 | 0.71 | ALDH1A1 (0.39) | KDM4ECRHR1 |
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-2008043791-A2 | THIOPHENE DERIVATIVES FOR TREATING HEPATITIS C | SMITHKLINE BEECHAM CORPORATION (US) | 2008-04-17 | — | — | WO | disclosed |
| WO-2008043791-A2 | THIOPHENE DERIVATIVES FOR TREATING HEPATITIS C | SMITHKLINE BEECHAM CORPORATION (US) | 2008-04-17 | — | — | WO | disclosed |