Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CFD | P00746 | 6/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | EP300 | Q09472 | 1/20 | 0.39 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | MARK3 | P27448 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL845332 | 0.94 | NPC1 (0.52) | NPC1MEN1KMT2ACFDLMNA | |
| SCHEMBL845083 | 0.79 | HSD11B1 (0.53) | CFDTRPV1MAPK1ALDH1A1HTT | |
| SCHEMBL10299164 | 0.77 | NPC1 (0.76) | NPC1MEN1KMT2ALMNANPSR1 | |
| SCHEMBL845227 | 0.77 | NPC1 (0.76) | NPC1MEN1KMT2ALMNANPSR1 | |
| SCHEMBL10281278 | 0.77 | NPC1 (0.76) | NPC1MEN1KMT2ALMNANPSR1 | |
| SCHEMBL845520 | 0.75 | MEN1 (0.53) | NPC1MEN1KMT2ALMNANPSR1 | |
| SCHEMBL844996 | 0.73 | CYP2C9 (0.50) | NPC1MEN1KMT2ALMNATRPV1 | |
| SCHEMBL845008 | 0.72 | ALDH1A1 (0.54) | MEN1KMT2ALMNANPSR1MAPK1 | |
| SCHEMBL845039 | 0.72 | TRPV1 (0.51) | MEN1KMT2ATRPV1MAPK1ALDH1A1 | |
| SCHEMBL13272271 | 0.71 | MEN1 (0.49) | NPC1MEN1KMT2ALMNANPSR1 |
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-8143288-B2 | Inhibitors of HCV replication | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-27 | — | — | US | disclosed |