Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.54 |
| ▸ | CA2 | P00918 | 6/20 | 0.53 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.40 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL216185 | 0.83 | PTPN1 (0.62) | PTPN1PTGS1PTGS2CA2PTPN11 | |
| SCHEMBL1976973 | 0.81 | PTPN1 (0.60) | PTPN1PTGS1PTGS2CA2PTPN11 | |
| SCHEMBL28665290 | 0.81 | PTPN1 (0.60) | PTPN1PTGS1PTGS2CA2PTPN11 | |
| SCHEMBL7528541 | 0.79 | PTPN11 (0.61) | PTPN1CA2PTPN11MAPK1SMN1; SMN2 | |
| SCHEMBL31373266 | 0.77 | PTGS1 (0.70) | PTGS1PTGS2CA2MAPK1SMN1; SMN2 | |
| SCHEMBL650947 | 0.77 | PTGS1 (0.70) | PTGS1PTGS2CA2MAPK1SMN1; SMN2 | |
| Trifluoromethanesulfonamide SCHEMBL4288876 | 0.77 | CA2 (0.62) | PTPN1PTGS1PTGS2CA2PTPN11 | |
| SCHEMBL6001500 | 0.76 | PTPN1 (0.86) | PTPN1PTGS1PTGS2CA2PTPN11 | |
| SCHEMBL14033372 | 0.75 | LMNA (0.59) | PTPN1CA2PTPN11MAPK1SMN1; SMN2 | |
| Diphenylsulfane SCHEMBL6382661 | 0.74 | ALDH1A1 (0.44) | PTPN1PTGS1PTGS2CA2MAPK1 |
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-114846014-A | Insect repellent compounds comprising azaindole structures | 英特维特国际股份有限公司 | 2022-08-02 | — | — | CN | disclosed |
| CN-114845994-A | Insect-repellent compound comprising quinoline structure | 英特维特国际股份有限公司 | 2022-08-02 | — | — | CN | disclosed |
| CN-102947278-B | 4-[5-[the chloro-5-of 3-(trifluoromethyl) phenyl]-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]-N-[2-oxo-2-[(2,2,2-trifluoroethyl) amino] ethyl] crystalline form of-1-naphthoamide | DUPONT (US) | 2015-08-12 | — | — | CN | disclosed |