Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.52 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.52 |
| ▸ | RELA | Q04206 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Cyclohexane SCHEMBL28440962 | 0.93 | RAB9A (0.47) | ACHELMNATSHRALOX12RAB9A | |
| Ethylene SCHEMBL28174356 | 0.92 | ACHE (0.56) | ACHELMNATSHRALOX12RAB9A | |
| Ethylene SCHEMBL23777302 | 0.92 | ACHE (0.56) | ACHELMNATSHRALOX12RAB9A | |
| SCHEMBL587 | 0.91 | ACHE (0.62) | ACHELMNATSHRALOX12RAB9A | |
| SCHEMBL22079642 | 0.91 | ACHE (0.62) | ACHELMNATSHRALOX12RAB9A | |
| SCHEMBL7412470 | 0.91 | ACHE (0.62) | ACHELMNATSHRALOX12RAB9A | |
| Tannin Pyrogallol SCHEMBL1419994 | 0.91 | ACHE (0.62) | ACHELMNATSHRALOX12RAB9A | |
| SCHEMBL27615647 | 0.89 | HPRT1 (0.55) | ACHELMNATSHRALOX12RAB9A | |
| SCHEMBL29220723 | 0.88 | ACHE (0.59) | ACHELMNATSHRALOX12RAB9A | |
| SCHEMBL22802548 | 0.88 | ACHE (0.59) | ACHELMNATSHRALOX12RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-100545140-C | High-purity (fluoroalkyl) benzene derivative and preparation method thereof | MITSUBISHI GAS CHEMICAL CO (JP) | 2009-09-30 | — | — | CN | disclosed |
| CN-1653029-A | High-purity (fluoroalkyl) benzene derivative and preparation method thereof | MITSUBISHI GAS CHEMICAL CO (JP) | 2005-08-10 | — | — | CN | disclosed |