Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 2/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | PYGL | P06737 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CASP3 | P42574 | 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 | |
|---|---|---|---|---|
| SCHEMBL4730791 | 0.95 | NPC1 (0.35) | PDK2ENPP2CYP11B1CYP11B2ABL1 | |
| SCHEMBL4729162 | 0.91 | CCR2 (0.36) | ABL1POLBNPSR1ALDH1A1NPC1 | |
| SCHEMBL4730786 | 0.85 | NPC1 (0.36) | ABL1POLBNPSR1ALDH1A1NPC1 | |
| SCHEMBL1961431 | 0.79 | CACNA2D1 (0.41) | KDM4EALDH1A1HPGDRAB9A | |
| SCHEMBL14223017 | 0.76 | KDM4E (0.33) | KDM4ENPSR1NPC1MAPTCASP3 | |
| SCHEMBL4729550 | 0.76 | NPC1 (0.38) | ABL1POLBMCOLN3KDM4ENPSR1 | |
| SCHEMBL1960202 | 0.76 | CYP2E1 (0.39) | ALDH1A1CNR2 | |
| SCHEMBL14290668 | 0.74 | CYP2E1 (0.34) | KDM4EALDH1A1NPC1RAB9A | |
| SCHEMBL4797906 | 0.73 | — | — | |
| SCHEMBL4797916 | 0.73 | — | — |
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-2008043791-A2 | THIOPHENE DERIVATIVES FOR TREATING HEPATITIS C | SMITHKLINE BEECHAM CORPORATION (US) | 2008-04-17 | — | — | WO | disclosed |