Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 8/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 8/20 | 0.38 |
| ▸ | ATM | Q13315 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.34 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HTR3A | P46098 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12730123 | 0.79 | P2RX7 (0.41) | NR1H2NR1H3ATMMAPTTSHR | |
| SCHEMBL12792071 | 0.71 | KMT2A (0.55) | ATMMAPTTSHRMAPK1CASP1 | |
| SCHEMBL24910306 | 0.68 | NR1H2 (0.47) | NR1H2NR1H3GRM2PDE10AHTR3A | |
| SCHEMBL10239600 | 0.66 | KMT2A (0.38) | ATMMAPTTSHRMAPK1CASP1 | |
| SCHEMBL1271026 | 0.65 | NR1H2 (0.56) | NR1H2NR1H3MAPTTSHRMEN1 | |
| SCHEMBL1272181 | 0.65 | NR1H2 (0.56) | NR1H2NR1H3MAPK1 | |
| SCHEMBL26375284 | 0.65 | CYP1A2 (0.47) | NR1H2NR1H3GRM2LMNAPDE10A | |
| SCHEMBL1272253 | 0.64 | NR1H2 (0.49) | NR1H2NR1H3PDE2APDE10AHTR3A | |
| SCHEMBL1272812 | 0.64 | NR1H2 (0.67) | NR1H2NR1H3MEN1KMT2A | |
| SCHEMBL1271040 | 0.64 | NR1H2 (0.67) | NR1H2NR1H3SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011038293-A1 | CYCLIC PEPTIDE INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2011-03-31 | — | — | WO | disclosed |