Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 5/20 | 0.40 |
| ▸ | CA6 | P23280 | 5/20 | 0.40 |
| ▸ | CA7 | P43166 | 5/20 | 0.40 |
| ▸ | CA9 | Q16790 | 5/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 5/20 | 0.40 |
| ▸ | CA2 | P00918 | 4/20 | 0.40 |
| ▸ | CA4 | P22748 | 4/20 | 0.40 |
| ▸ | CA5A | P35218 | 4/20 | 0.40 |
| ▸ | CA3 | P07451 | 3/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.39 |
| ▸ | CASP2 | P42575 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18120963 | 0.96 | CYP2C19 (0.43) | CYP2C19CYP2C9TSHRALDH1A1TDP1 | |
| SCHEMBL8346751 | 0.96 | CYP2C19 (0.43) | CYP2C19CYP2C9TSHRALDH1A1TDP1 | |
| SCHEMBL11744945 | 0.94 | CYP2C19 (0.42) | CYP2C19CYP2C9TSHRALDH1A1TDP1 | |
| SCHEMBL9452827 | 0.92 | ALDH1A1 (0.52) | CYP2C19CYP2C9TSHRALDH1A1TDP1 | |
| SCHEMBL9452846 | 0.92 | ALDH1A1 (0.52) | CYP2C19CYP2C9TSHRALDH1A1TDP1 | |
| SCHEMBL11520416 | 0.90 | TSHR (0.50) | CYP2C19CYP2C9TSHRALDH1A1TDP1 | |
| SCHEMBL18244864 | 0.89 | TSHR (0.55) | CYP2C19CYP2C9TSHRALDH1A1TDP1 | |
| SCHEMBL8047263 | 0.88 | ALDH1A1 (0.48) | CYP2C19CYP2C9TSHRALDH1A1TDP1 | |
| SCHEMBL11743886 | 0.88 | ALDH1A1 (0.48) | CYP2C19CYP2C9TSHRALDH1A1TDP1 | |
| SCHEMBL9322889 | 0.88 | ALDH1A1 (0.48) | CYP2C19CYP2C9TSHRALDH1A1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20230192929-A1 | COMPOSITIONS COMPRISING MULTIPLE CHARGED CATIONIC COMPOUNDS FOR SOIL RELEASE | ECOLAB USA INC. | 2023-06-22 | — | — | US | disclosed |
| US-20180169629-A1 | METHOD FOR RECOVERING CATALYST | ZEON CORPORATION (JP) | 2018-06-21 | — | — | US | disclosed |