Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | ACLY | P53396 | 1/20 | 0.44 |
| ▸ | ACACB | O00763 | 1/20 | 0.43 |
| ▸ | ACACA | Q13085 | 1/20 | 0.43 |
| ▸ | KDM5A | P29375 | 3/20 | 0.41 |
| ▸ | PHF8 | Q9UPP1 | 3/20 | 0.41 |
| ▸ | KDM2A | Q9Y2K7 | 3/20 | 0.41 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.41 |
| ▸ | KDM4A | O75164 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL528267 | 0.88 | HPGD (0.40) | CYP1A2ACLYACACBACACAEPHX1 | |
| Methylamine SCHEMBL27794790 | 0.82 | CYP2D6 (0.38) | CYP1A2ACLYACACBACACAEPHX1 | |
| SCHEMBL6190677 | 0.80 | CYP1A2 (0.47) | CYP1A2KDM5APHF8KDM2AKDM4C | |
| SCHEMBL30310871 | 0.78 | PPARA (0.43) | CYP1A2ACLYACACBACACASMN1; SMN2 | |
| SCHEMBL4141844 | 0.78 | GRM2 (0.46) | CYP1A2EPHX1SMN1; SMN2HPGD | |
| SCHEMBL25826250 | 0.78 | GRM2 (0.46) | CYP1A2EPHX1SMN1; SMN2HPGD | |
| SCHEMBL11482038 | 0.78 | CYP1A2 (0.44) | CYP1A2KDM5APHF8KDM2AKDM4C | |
| SCHEMBL7275099 | 0.77 | SIGMAR1 (0.44) | CYP1A2KDM5APHF8KDM2AKDM4C | |
| SCHEMBL30310781 | 0.77 | ACLY (0.44) | CYP1A2ACLYACACBACACAEPHX1 | |
| SCHEMBL30310863 | 0.77 | PPARA (0.42) | CYP1A2ACLYACACBACACAEPHX1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9145570-B2 | Enzymatic acylation method using an acylphosphonate donor | PCAS BIOSOLUTION (FR) | 2015-09-29 | — | — | US | disclosed |
| EP-2598644-A1 | ENZYMATIC ACYLATION METHOD USING AN ACYLPHOSPHONATE DONOR | PCAS Biosolution (FR) | 2013-06-05 | — | — | EP | disclosed |
| US-20130130337-A1 | Enzymatic Acylation Method Using an Acylphosphonate Donor | PCAS BIOSOLUTION (FR) | 2013-05-23 | — | — | US | disclosed |
| WO-2012013765-A1 | ENZYMATIC ACYLATION METHOD USING AN ACYLPHOSPHONATE DONOR | PCAS BIOSOLUTION (FR) | 2012-02-02 | — | — | WO | disclosed |