Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17743971 | 0.84 | POLB (0.49) | KMT2APPARAALKBH1CA12CA1 | |
| SCHEMBL31114215 | 0.77 | PPARA (0.51) | PPARA | |
| SCHEMBL6112752 | 0.77 | PPARA (0.51) | PPARA | |
| SCHEMBL16318871 | 0.76 | CYP4F2 (0.56) | KMT2APPARAMEN1 | |
| SCHEMBL3234088 | 0.74 | CXCL8 (0.53) | KMT2APPARAALKBH1CA12CA1 | |
| SCHEMBL16794999 | 0.74 | HTR2A (0.46) | PPARAALKBH1CA12CA1CA2 | |
| SCHEMBL28873077 | 0.73 | KMT2A (0.42) | KMT2APPARAALKBH1CA12CA1 | |
| SCHEMBL2428496 | 0.72 | ALOX5 (0.49) | KMT2APPARACA12CA1CA2 | |
| SCHEMBL17583887 | 0.71 | MTNR1A (0.73) | HTR2CMTNR1AMTNR1B | |
| SCHEMBL172225 | 0.71 | HTR2A (0.46) | PPARACA12CA1CA2CA7 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109704980-B | Preparation method of (Z) -3-amino-2- (2-fluoro-3-methoxyphenyl) -2-ethyl crotonate | 安徽大学 | 2022-05-13 | — | — | CN | claimed |
| CN-109734616-B | Method for synthesizing (Z) -3-amino-2- (2-fluoro-3-methoxyphenyl) -2-ethyl crotonate by two-step method | 安徽诺全药业有限公司 | 2022-05-13 | — | — | CN | claimed |
| CN-109704980-B | Preparation method of (Z) -3-amino-2- (2-fluoro-3-methoxyphenyl) -2-ethyl crotonate | 安徽大学 | 2022-05-13 | — | — | CN | disclosed |
| CN-109704980-B | Preparation method of (Z) -3-amino-2- (2-fluoro-3-methoxyphenyl) -2-ethyl crotonate | 安徽大学 | 2022-05-13 | — | — | CN | disclosed |
| CN-109734616-B | Method for synthesizing (Z) -3-amino-2- (2-fluoro-3-methoxyphenyl) -2-ethyl crotonate by two-step method | 安徽诺全药业有限公司 | 2022-05-13 | — | — | CN | disclosed |
| CN-109734616-B | Method for synthesizing (Z) -3-amino-2- (2-fluoro-3-methoxyphenyl) -2-ethyl crotonate by two-step method | 安徽诺全药业有限公司 | 2022-05-13 | — | — | CN | disclosed |
| CN-109734616-A | Method for synthesizing (Z) -3-amino-2- (2-fluoro-3-methoxyphenyl) -2-ethyl crotonate by two-step method | 安徽诺全药业有限公司 | 2019-05-10 | — | — | CN | disclosed |
| CN-109704980-A | Preparation method of (Z) -3-amino-2- (2-fluoro-3-methoxyphenyl) -2-ethyl crotonate | 安徽诺全药业有限公司 | 2019-05-03 | — | — | CN | disclosed |