Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.63 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.54 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.54 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | JAK2 | O60674 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.44 |
| ▸ | DPP4 | P27487 | 2/20 | 0.43 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.43 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.43 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10299164 | 0.90 | NPC1 (0.76) | NPC1MEN1KMT2ALMNANPSR1 | |
| SCHEMBL845227 | 0.90 | NPC1 (0.76) | NPC1MEN1KMT2ALMNANPSR1 | |
| SCHEMBL10281278 | 0.90 | NPC1 (0.76) | NPC1MEN1KMT2ALMNANPSR1 | |
| SCHEMBL10119593 | 0.90 | NPC1 (0.51) | NPC1MEN1KMT2ASCN9ASCN3A | |
| SCHEMBL872886 | 0.88 | KDM4E (0.52) | NPC1MEN1KMT2ALMNANPSR1 | |
| SCHEMBL10119639 | 0.84 | MEN1 (0.46) | NPC1MEN1KMT2ASCN9ASCN3A | |
| SCHEMBL10119687 | 0.83 | CYP2C9 (0.44) | NPC1ALDH1A1MAPK1HTTHDAC8 | |
| SCHEMBL3736620 | 0.81 | NPC1 (0.54) | NPC1MEN1KMT2ASCN9ASCN3A | |
| SCHEMBL628425 | 0.81 | NPC1 (0.54) | NPC1MEN1KMT2ASCN9ASCN3A | |
| SCHEMBL3736622 | 0.81 | NPC1 (0.54) | NPC1MEN1KMT2ASCN9ASCN3A |
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 |
|---|---|---|---|---|---|---|---|
| US-8143288-B2 | Inhibitors of HCV replication | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-27 | — | — | US | disclosed |
| US-8143288-B2 | Inhibitors of HCV replication | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-27 | — | — | US | disclosed |