Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 13/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | NAAA | Q02083 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL42439 | 0.93 | — | — | |
| Butane SCHEMBL28879542 | 0.90 | EPHX1 (0.56) | EPHX1ACHEMMP2ALOX15 | |
| SCHEMBL10959270 | 0.90 | — | — | |
| Hydrogen Sulfide SCHEMBL27527355 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL2398903 | 0.90 | — | — | |
| Iodide SCHEMBL23242193 | 0.90 | — | — | |
| Hexane SCHEMBL28335720 | 0.90 | EPHX1 (0.62) | EPHX1NAAAACHEMMP2ALOX15 | |
| Formaldehyde SCHEMBL20162220 | 0.88 | EPHX1 (0.54) | EPHX1ACHEMMP2ALOX15 | |
| Acetic Acid SCHEMBL7390729 | 0.88 | EPHX1 (0.54) | EPHX1ACHEMMP2ALOX15 | |
| Decane SCHEMBL28485197 | 0.88 | EPHX1 (0.67) | EPHX1NAAAACHE |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110546135-B | Method for producing isocyanate | 旭化成株式会社 | 2021-12-14 | — | — | CN | disclosed |
| CN-112020493-A | Method for producing carbamate and method for producing isocyanate | 旭化成株式会社 | 2020-12-01 | — | — | CN | disclosed |
| CN-110546135-A | Method for producing isocyanate | ASAHI CHEMICAL IND | 2019-12-06 | — | — | CN | disclosed |