Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28312015 | 0.90 | IDO1 (0.46) | SIGMAR1HRH3MEN1KMT2AIDO1 | |
| SCHEMBL2237483 | 0.81 | TSHR (0.41) | MEN1KMT2AOPRM1OPRL1CYP2C19 | |
| SCHEMBL21638945 | 0.79 | TSHR (0.43) | MEN1KMT2AOPRM1OPRL1CYP2C19 | |
| SCHEMBL6722030 | 0.79 | SIGMAR1 (0.38) | CA1CA2CA9TDP1SIGMAR1 | |
| SCHEMBL6729320 | 0.76 | TSHR (0.36) | CA1CA2CA9SIGMAR1HRH3 | |
| SCHEMBL2126979 | 0.76 | TSHR (0.45) | CA1CA2CA9OPRM1 | |
| SCHEMBL5139043 | 0.76 | TSHR (0.43) | CA1CA2CA9MEN1KMT2A | |
| SCHEMBL5164870 | 0.73 | FFAR4 (0.47) | TDP1MEN1KMT2A | |
| SCHEMBL5722434 | 0.73 | MEN1 (0.43) | MEN1KMT2AOPRM1CYP3A4CYP2C19 | |
| SCHEMBL31187955 | 0.72 | MAOA (0.45) | CA1CA2CA9SIGMAR1CYP3A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5094723-A | Separation of m-xylene from p-xylene or o-xylene by extractive distillation with alcohols | Berg, Lloyd (US) | 1992-03-10 | — | — | US | disclosed |