Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | PPARD | Q03181 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.43 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL24534352 | 1.00 | CA2 (0.50) | CA2CYP19A1ATMKDM4EALDH1A1 | |
| SCHEMBL27873824 | 1.00 | CA2 (0.50) | CA2CYP19A1ATMKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL27962953 | 0.98 | CYP19A1 (0.49) | CA2CYP19A1ATMKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL5035634 | 0.98 | CYP19A1 (0.49) | CA2CYP19A1ATMKDM4EALDH1A1 | |
| SCHEMBL9162474 | 0.86 | TAAR1 (0.54) | ALDH1A1TSHRCYP3A4LMNAMAPK1 | |
| SCHEMBL16974124 | 0.83 | CA2 (0.53) | CA2CYP19A1ATMKDM4EALDH1A1 | |
| SCHEMBL25846300 | 0.83 | ALDH1A1 (0.45) | CYP19A1KDM4EALDH1A1PPARGPPARD | |
| SCHEMBL11258047 | 0.81 | CA2 (0.59) | CA2CYP19A1ATMKDM4EALDH1A1 | |
| SCHEMBL31432907 | 0.81 | CYP19A1 (0.50) | CA2CYP19A1ATMKDM4EALDH1A1 | |
| SCHEMBL31149052 | 0.81 | CYP19A1 (0.50) | CA2CYP19A1ATMKDM4EALDH1A1 |
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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116987004-B | Synthesis method of 3- (3, 4-dimethoxy phenyl) -2-amino-2-methylpropanenitrile | 新华制药（寿光）有限公司 | 2023-12-12 | — | — | CN | claimed |
| CN-116987004-A | Synthesis method of 3- (3, 4-dimethoxy phenyl) -2-amino-2-methylpropanenitrile | 新华制药（寿光）有限公司 | 2023-11-03 | — | — | CN | claimed |
| CN-102702004-B | Method for preparing methyldopa from alpha-methyl-(3,4-dimethoxy phenyl)-alpha-aminopropionitrile by microwave hydrolysis method | ZHEJIANG CHIRAL MEDICINE CHEMICALS CO LTD | 2014-06-04 | — | — | CN | claimed |
| US-4187244-A | Process for the resolution of racemic alpha-aminonitriles | KRKA, Farmaceutika, Kemija, Kozmetika, zdravilisca in gostinstuo, Novo mesto, n.sd.o. (YU) | 1980-02-05 | — | — | US | claimed |
| US-4183865-A | SALT FORMATION WITH (-)DIBENZOYL TARTARIC ACID IN A POLAR SOLVENT | KRKA, FARMACEVTIKA, KEMIJA, KOZMETIKA, ZDRAVILISCA IN GOSTINSTVO, NOVO MESTO, N.SOL.O. (YU) | 1980-01-15 | — | — | US | claimed |
| JP-61275253-A | — | — | None | — | — | JP | disclosed |
| JP-61280461-A | — | — | None | — | — | JP | disclosed |
| JP-61280461-A | — | — | None | — | — | JP | disclosed |
| JP-62298565-A | — | — | None | — | — | JP | disclosed |
| JP-62298567-A | — | — | None | — | — | JP | disclosed |
| CN-116987004-B | Synthesis method of 3- (3, 4-dimethoxy phenyl) -2-amino-2-methylpropanenitrile | 新华制药（寿光）有限公司 | 2023-12-12 | — | — | CN | disclosed |
| CN-116987004-B | Synthesis method of 3- (3, 4-dimethoxy phenyl) -2-amino-2-methylpropanenitrile | 新华制药（寿光）有限公司 | 2023-12-12 | — | — | CN | disclosed |
| WO-2007002318-A2 | BIOADHESIVE POLYMERS | SPHERICS, INC. (US) | 2007-01-04 | — | — | WO | disclosed |
| JP-S62298567-A | PRODUCTION OF HIGH-PURITY DL-AMINONITRILE | NIPPON KAYAKU CO LTD | 1987-12-25 | — | — | JP | disclosed |
| JP-S62298565-A | PRODUCTION OF L-ALPHA-METHYLDOPA | NIPPON KAYAKU CO LTD | 1987-12-25 | — | — | JP | disclosed |
| JP-S61280461-A | PRODUCTION OF L-2-AMINO-3-(3,4-DIMETHOXYPHENYL)-2-METHYLPROPIONITRILE | NIPPON KAYAKU CO LTD | 1986-12-11 | — | — | JP | disclosed |
| JP-S61280461-A | PRODUCTION OF L-2-AMINO-3-(3,4-DIMETHOXYPHENYL)-2-METHYLPROPIONITRILE | NIPPON KAYAKU CO LTD | 1986-12-11 | — | — | JP | disclosed |
| JP-S61275253-A | PRODUCTION OF 3-(3,4-DIHYDROXYPHENYL)-2-METHYLALANINE | NIPPON KAYAKU CO LTD | 1986-12-05 | — | — | JP | disclosed |
| US-4187244-A | Process for the resolution of racemic alpha-aminonitriles | KRKA, Farmaceutika, Kemija, Kozmetika, zdravilisca in gostinstuo, Novo mesto, n.sd.o. (YU) | 1980-02-05 | — | — | US | disclosed |
| US-4183865-A | SALT FORMATION WITH (-)DIBENZOYL TARTARIC ACID IN A POLAR SOLVENT | KRKA, FARMACEVTIKA, KEMIJA, KOZMETIKA, ZDRAVILISCA IN GOSTINSTVO, NOVO MESTO, N.SOL.O. (YU) | 1980-01-15 | — | — | US | disclosed |