Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 3/20 | 0.41 |
| ▸ | CTSK | P43235 | 2/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | CTSC | P53634 | 2/20 | 0.40 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 3/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | ALPI | P09923 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | XIAP | P98170 | 1/20 | 0.39 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11856064 | 0.82 | CTSB (0.38) | ESR1ESR2CTSSCTSLCTSB | |
| SCHEMBL4980139 | 0.80 | DPP4 (0.45) | CTSSCTSKCTSC | |
| SCHEMBL11857401 | 0.79 | ATM (0.47) | CTSSCTSKCTSLCTSBPTGS1 | |
| SCHEMBL1833635 | 0.79 | TRPA1 (0.55) | TRPA1CYP1A2EPHX1SRRALPI | |
| SCHEMBL15195458 | 0.79 | CYP1A2 (0.47) | TRPA1MAOBCYP1A2EPHX1SRR | |
| SCHEMBL9014783 | 0.79 | CYP1A2 (0.47) | TRPA1MAOBCYP1A2EPHX1SRR | |
| SCHEMBL22868014 | 0.78 | MAOB (0.47) | MAOBCYP1A2ESR1ESR2CTSS | |
| SCHEMBL10431094 | 0.77 | CSNK1E (0.51) | TRPA1EPHX1CTSCALPIPKM | |
| SCHEMBL11829664 | 0.77 | MAOB (0.46) | MAOBESR1ESR2 | |
| Ammonia Solution, Strong SCHEMBL29021310 | 0.77 | TRPA1 (0.53) | TRPA1CYP1A2EPHX1SRRALPI |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1260345-C | Novel microorganisms and process for producing | DAICEL CHEM (JP) | 2006-06-21 | — | — | CN | disclosed |
| US-6699695-B1 | FOR EXAMPLE, CONVERTING 2-HYDROXY-4-METHYLTHIOBUTYRONITRILE INTO THE CORRESPONDING AMIDE, WHICH IS A PRECURSOR TO THE FEED SUPPLEMENT 2-HYDROXY-4-METHYLTHIOBUTYRIC ACID | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2004-03-02 | — | — | US | disclosed |
| CN-1290296-A | Novel microorganisms and process for producing | DAICEL CHEM (JP) | 2001-04-04 | — | — | CN | disclosed |
| EP-1055724-A1 | MICROORGANISMS AND PROCESS FOR PRODUCING AMIDE COMPOUNDS | Daicel Chemical Industries, Ltd. (JP) | 2000-11-29 | — | — | EP | disclosed |
| EP-0357545-A2 | Cationic compounds, their preparation and their use in the photochemical stabilisation of basic dyeable polyamide polyacrylonitrile and polyester fibres | CIBA-GEIGY AG (CH) | 1990-03-07 | — | — | EP | disclosed |