Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 6/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.40 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MC4R | P32245 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Cadaverine Tartrate SCHEMBL16685626 | 0.89 | LMNA (0.44) | CYP2D6CYP1A2CYP3A4LMNAADRA2A | |
| SCHEMBL515536 | 0.85 | CYP3A4 (0.40) | CYP2D6CYP3A4KCNA5CYP2C19LMNA | |
| SCHEMBL16685702 | 0.82 | TP53 (0.51) | CYP2D6CYP1A2CYP2C19LMNAALDH1A1 | |
| SCHEMBL16685629 | 0.80 | LMNA (0.39) | CYP2D6CYP1A2CYP3A4LMNAADRA2A | |
| SCHEMBL8082292 | 0.80 | CYP2D6 (0.43) | CYP2D6CYP1A2CYP3A4CYP2C9KCNA5 | |
| SCHEMBL7480934 | 0.77 | CYP2D6 (0.47) | CYP2D6CYP1A2CYP3A4CYP2C9KCNA5 | |
| SCHEMBL28042294 | 0.75 | CYP2D6 (0.50) | CYP2D6CYP1A2CYP3A4CYP2C9KCNA5 | |
| Hydrochloric Acid SCHEMBL29424742 | 0.75 | CYP2D6 (0.46) | CYP2D6CYP1A2CYP3A4CYP2C9KCNA5 | |
| SCHEMBL1802065 | 0.74 | CYP3A4 (0.52) | CYP2D6CYP1A2CYP3A4CYP2C9KCNA5 | |
| Hydrochloric Acid SCHEMBL7654483 | 0.72 | CYP3A4 (0.50) | CYP2D6CYP1A2CYP3A4CYP2C9KCNA5 |
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 77 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110382470-B | Preparation method of efavirenz | 纳尔逊·曼德拉都市大学 | 2023-06-06 | — | — | CN | claimed |
| CN-110382470-A | The preparation method of efavirenz | 纳尔逊·曼德拉都市大学 | 2019-10-25 | — | — | CN | claimed |
| EP-3548469-A1 | METHOD FOR THE MANUFACTURE OF EFAVIRENZ | Nelson Mandela Metropolitan University (ZA) | 2019-10-09 | — | — | EP | claimed |
| CN-104805148-B | The biological preparation method of one kind (1R, 2S)-N- pyrrolidinyl norephedrine | 苏州汉酶生物技术有限公司 | 2019-02-01 | — | — | CN | claimed |
| WO-2018154414-A1 | METHOD FOR THE MANUFACTURE OF EFAVIRENZ | NELSON MANDELA METROPOLITAN UNIVERSITY (ZA) | 2018-08-30 | — | — | WO | claimed |
| WO-2015063795-A2 | NOVEL PROCESS FOR PREPARATION OF OPTICALLY PURE NOREPHEDRINE AND ITS DERIVATIVES | LAURUS LABS PRIVATE LIMITED (IN) | 2015-05-07 | — | — | WO | claimed |
| WO-2011141934-A1 | AN IMPROVED PROCESS FOR THE PREPARATION OF AN INTERMEDIATE OF HMG-COA REDUCTASE INHIBITORS | MATRIX LABORATORIES LTD. (IN) | 2011-11-17 | — | — | WO | claimed |
| EP-0981520-A1 | EFFICIENT ENANTIOSELECTIVE ADDITION REACTION USING AN ORGANOZINC REAGENT | Merck & Co., Inc. (US) | 2000-03-01 | — | — | EP | claimed |
| WO-1998051676-A1 | EFFICIENT ENANTIOSELECTIVE ADDITION REACTION USING AN ORGANOZINC REAGENT | MERCK & CO., INC. (US) | 1998-11-19 | — | — | WO | claimed |
| CN-110382470-B | Preparation method of efavirenz | 纳尔逊·曼德拉都市大学 | 2023-06-06 | — | — | CN | disclosed |
| CN-110382470-A | The preparation method of efavirenz | 纳尔逊·曼德拉都市大学 | 2019-10-25 | — | — | CN | disclosed |
| EP-3548469-A1 | METHOD FOR THE MANUFACTURE OF EFAVIRENZ | Nelson Mandela Metropolitan University (ZA) | 2019-10-09 | — | — | EP | disclosed |
| CN-104805148-B | The biological preparation method of one kind (1R, 2S)-N- pyrrolidinyl norephedrine | 苏州汉酶生物技术有限公司 | 2019-02-01 | — | — | CN | disclosed |
| CN-104805148-B | The biological preparation method of one kind (1R, 2S)-N- pyrrolidinyl norephedrine | 苏州汉酶生物技术有限公司 | 2019-02-01 | — | — | CN | disclosed |
| US-5698741-A | HIV REVERSE TRANSCRIPTASE INHIBITOR | MERCK & CO. INC. (US) | 1997-12-16 | — | — | US | disclosed |
| EP-0805790-A1 | IMPROVED SYNTHESIS OF CYCLOPROPYLACETYLENE | Merck & Co., Inc. (US) | 1997-11-12 | — | — | EP | disclosed |
| US-5663467-A | BASIC REACTION OF 5-HALO-1-PENTYNE IN APROTIC SOLVENT, HEATING AND CYCLIZATION THEN QUENCHING | MERCK & CO., INC. (US) | 1997-09-02 | — | — | US | disclosed |
| US-5633405-A | REACTING SUBSTITUTED NOREPHEDRINE WITH CYCLOPROPYLACETYLENE AND LITHIATING AGENT IN APROTIC SOLVENT, MIXING WITH ANILINE TRIFLUOROMETHYL KETONE, QUENCHING WITH PROTON SOURCE | MERCK & CO., INC. (US) | 1997-05-27 | — | — | US | disclosed |
| WO-1996037457-A1 | ASYMMETRIC SYNTHESIS OF (-) 6-CHLORO-4-CYCLOPROPYL-ETHYNYL-4-TRIFLUOROMETHYL-1,4-DIHYDRO-2H-3,1-BENZOXAZIN-2-ONE | MERCK & CO., INC. (US) | 1996-11-28 | — | — | WO | disclosed |
| WO-1996022955-A1 | IMPROVED SYNTHESIS OF CYCLOPROPYLACETYLENE | MERCK & CO., INC. (US) | 1996-08-01 | — | — | WO | disclosed |