Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXFP1 | Q9HBX9 | 9/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | RORC | P51449 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.34 |
| ▸ | HTR3B | O95264 | 1/20 | 0.34 |
| ▸ | HTR3A | P46098 | 1/20 | 0.34 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.34 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | PRNP | P04156 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1072461 | 0.89 | SMN1; SMN2 (0.35) | ALDH1A1RORCACACBKMT2AMEN1 | |
| SCHEMBL1274041 | 0.88 | ACACB (0.34) | ACACBKMT2AMEN1HTR3EHTR3B | |
| SCHEMBL1072632 | 0.85 | SMN1; SMN2 (0.36) | ALDH1A1ACACBKMT2AMEN1LMNA | |
| SCHEMBL1244115 | 0.79 | PIK3CD (0.47) | ALDH1A1NPSR1LMNA | |
| SCHEMBL8248157 | 0.78 | UCHL1 (0.47) | RXFP1MAPTALDH1A1ACACB | |
| SCHEMBL2431240 | 0.78 | RORC (0.35) | RORC | |
| SCHEMBL1072152 | 0.77 | MEN1 (0.41) | RORCACACBKMT2AMEN1POLB | |
| SCHEMBL1083306 | 0.77 | MEN1 (0.41) | RORCACACBKMT2AMEN1POLB | |
| SCHEMBL3305623 | 0.77 | NCEH1 (0.40) | RXFP1MAPTALDH1A1RORCKMT2A | |
| SCHEMBL1068681 | 0.76 | KDM4E (0.36) | ALDH1A1ACACBKMT2AMEN1POLB |
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-7879797-B2 | HCV NS3 protease inhibitors | MERCK SHARP & DOHME CORP. (US) | 2011-02-01 | — | — | US | disclosed |