Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | VEGFA | P15692 | 1/20 | 0.41 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | PLG | P00747 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | CTSG | P08311 | 1/20 | 0.39 |
| ▸ | CMA1 | P23946 | 1/20 | 0.39 |
| ▸ | CTRC | Q99895 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9118024 | 0.78 | CYP3A4 (0.51) | HTTSMN1; SMN2KDM4ETP53CYP2D6 | |
| SCHEMBL14600369 | 0.77 | KMT2A (0.45) | HTTSMN1; SMN2KDM4ETP53CYP2D6 | |
| SCHEMBL5800712 | 0.76 | HPGD (0.49) | HTTSMN1; SMN2KDM4ETP53CYP2D6 | |
| SCHEMBL4494422 | 0.75 | MAPK14 (0.46) | HTTSMN1; SMN2KDM4ETP53CYP2D6 | |
| SCHEMBL27478800 | 0.74 | F2 (0.54) | HTTSMN1; SMN2KDM4ETP53CYP2D6 | |
| SCHEMBL27422651 | 0.74 | MAPK14 (0.47) | HTTSMN1; SMN2KDM4ETP53CYP2D6 | |
| SCHEMBL23260078 | 0.74 | POLB (0.36) | POLB | |
| SCHEMBL31213514 | 0.72 | P2RX3 (0.48) | KMT2AMEN1HPGDLGMN | |
| SCHEMBL7519636 | 0.71 | KMT2A (0.52) | KDM4EKMT2AMEN1HPGD | |
| SCHEMBL3993878 | 0.71 | MAPK14 (0.45) | HTTSMN1; SMN2KDM4ETP53CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1169310-A1 | PROCESS FOR PREPARING MKC-442 | Triangle Pharmaceuticals Inc. (US) | 2002-01-09 | — | — | EP | disclosed |
| WO-2000061566-A1 | PROCESS FOR PREPARING MKC-442 | TRIANGLE PHARMACEUTICALS, INC. (US) | 2000-10-19 | — | — | WO | disclosed |