Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 2/20 | 0.36 |
| ▸ | CES1 | P23141 | 2/20 | 0.36 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL15659608 | 0.98 | DNM1 (0.39) | LTA4HSIGMAR1CES2CES1DNM1 | |
| SCHEMBL4750482 | 0.93 | LTA4H (0.36) | LTA4HSIGMAR1CES2CES1PCSK9 | |
| SCHEMBL2916053 | 0.89 | CYP3A4 (0.39) | SIGMAR1TP53CYP3A4TDP1ESR1 | |
| SCHEMBL9492996 | 0.86 | CYP3A4 (0.41) | TP53CYP3A4TDP1ESR1ESR2 | |
| SCHEMBL7558647 | 0.84 | CYP3A4 (0.39) | LTA4HSIGMAR1CES2CES1PCSK9 | |
| SCHEMBL9441831 | 0.81 | CYP3A4 (0.45) | KCNH2TP53CYP3A4TDP1ESR1 | |
| SCHEMBL13391635 | 0.81 | CYP3A4 (0.45) | KCNH2TP53CYP3A4TDP1ESR1 | |
| SCHEMBL2550792 | 0.80 | LTA4H (0.38) | LTA4HSIGMAR1CES2CES1DNM1 | |
| SCHEMBL808438 | 0.80 | LTA4H (0.38) | LTA4HSIGMAR1CES2CES1DNM1 | |
| SCHEMBL15659431 | 0.79 | HTT (0.42) | KCNH2MEN1TP53KMT2ATDP1 |
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-101855189-A | Process for producing alcohol | MITSUBISHI CHEM CORP | 2010-10-06 | — | — | CN | disclosed |
| EP-0121965-A2 | Process for the preparation of polyketones | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1984-10-17 | — | — | EP | disclosed |