Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | ACP3 | P15309 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | DPP4 | P27487 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL575475 | 0.81 | MPO (0.40) | MPOACP3DPP4TSHRF2 | |
| SCHEMBL2489197 | 0.81 | MPO (0.40) | MPOACP3CYP2D6SRCDPP4 | |
| SCHEMBL4261115 | 0.77 | MPO (0.38) | MPOACP3DPP4TSHRF2 | |
| SCHEMBL11266650 | 0.70 | BCAT2 (0.40) | MPOACP3CYP2D6SRCLMNA | |
| SCHEMBL10526030 | 0.70 | ALDH1A1 (0.39) | CYP2D6SRCLMNAMAPK1ALDH1A1 | |
| SCHEMBL2968063 | 0.69 | CYP2D6 (0.39) | ACP3CYP2D6SRCLMNADPP4 | |
| SCHEMBL44838 | 0.69 | AOC3 (0.47) | LMNATSHRMAPK1 | |
| SCHEMBL3077737 | 0.69 | AOC3 (0.47) | LMNATSHRMAPK1 | |
| SCHEMBL1669527 | 0.69 | AOC3 (0.47) | LMNATSHRMAPK1 | |
| SCHEMBL576245 | 0.68 | POLB (0.37) | MPOACP3DPP4TSHRF2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1139103-A | Process for synthesis of hydrocarbon compounds which are fluorinated on carbon of alkyl chain | RHONE POULENC CHIMIE (FR) | 1997-01-01 | — | — | CN | disclosed |