Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | CCR1 | P32246 | 4/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | BCR | P11274 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15691813 | 1.00 | CYP3A4 (0.44) | CYP3A4CYP2C19POLBKMT2AMEN1 | |
| SCHEMBL12755260 | 0.90 | CYP3A4 (0.49) | CYP3A4CYP2C19POLBKMT2AMEN1 | |
| SCHEMBL888973 | 0.90 | CYP3A4 (0.49) | CYP3A4CYP2C19POLBKMT2AMEN1 | |
| SCHEMBL12771425 | 0.83 | POLB (0.40) | CYP3A4CYP2C19POLBKMT2AMEN1 | |
| SCHEMBL15691823 | 0.81 | PTPN1 (0.53) | CYP3A4POLBKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL15458238 | 0.81 | DPP4 (0.47) | CYP3A4CYP2C19CCR1ABL1BCR | |
| SCHEMBL17303216 | 0.81 | DPP4 (0.47) | CYP3A4CYP2C19CCR1ABL1BCR | |
| SCHEMBL3266695 | 0.81 | DPP4 (0.47) | CYP3A4CYP2C19CCR1ABL1BCR | |
| SCHEMBL12824315 | 0.81 | CCR1 (0.38) | CYP3A4CYP2C19KMT2AMEN1CCR1 | |
| SCHEMBL12824396 | 0.81 | CCR1 (0.38) | CYP3A4CYP2C19KMT2AMEN1CCR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8815928-B2 | Hepatitis C virus inhibitors | ENANTA PHARMACEUTICALS, INC. (US) | 2014-08-26 | — | — | US | disclosed |