Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL266310

CC1CC1c1ccccc1.N

nearest known ligand 0.54

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 10/20 0.54
▸ HTR2C P28335 9/20 0.54
▸ MAOA P21397 7/20 0.54
▸ KDM1A O60341 5/20 0.54
▸ CYP2C19 P33261 4/20 0.54
▸ CYP2B6 P20813 3/20 0.54
▸ CYP1A2 P05177 2/20 0.54
▸ CYP2D6 P10635 2/20 0.54
▸ CYP2C9 P11712 2/20 0.54
▸ LMNA P02545 2/20 0.54
▸ TAAR1 Q96RJ0 2/20 0.54
▸ CYP3A4 P08684 1/20 0.54
▸ HTR1A P08908 1/20 0.54
▸ ADRA2A P08913 1/20 0.54
▸ CYP2A6 P11509 1/20 0.54
▸ SLC6A2 P23975 1/20 0.54
▸ ADRA1A P35348 1/20 0.54
▸ DRD3 P35462 1/20 0.54
▸ SLC6A3 Q01959 1/20 0.54
▸ KCNH2 Q12809 1/20 0.54

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL20195820 0.97 MAOB (0.56) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL187439 0.97 MAOB (0.56) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL7216730 0.97 MAOB (0.56) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL21111934 0.97 MAOB (0.56) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL9228291 0.88 MAOB (0.48) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL11851470 0.84 MAOB (0.56) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL5682494 0.80 MAOB (0.45) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL5682467 0.80 MAOB (0.45) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL8845464 0.77 MAOB (0.65) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL2261976 0.77 MAOB (0.65) MAOBHTR2CMAOAKDM1ACYP2C19

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116354892-A SIRT5 protein inhibitor and application thereof 西华大学 2023-06-30 — — CN disclosed
CN-103998461-B For the biocatalyst and method of the lactams for synthesizing substitution 科德克希思公司 2018-02-02 — — CN disclosed
CN-104508126-B Biocatalysts and methods for synthesizing derivatives of tryptamine and tryptamine analogs 科德克希思公司 2017-06-30 — — CN disclosed
CN-104185634-B Chemical process for preparing spiroindolones and intermediates thereof 诺华股份有限公司 2017-05-03 — — CN disclosed
US-8431378-B2 Aminotransferase, gene encoding the same, and methods of using them KANEKA CORPORATION (JP) 2013-04-30 — — US disclosed
US-20120164724-A1 NOVEL AMINOTRANSFERASE, GENE ENCODING THE SAME, AND METHODS OF USING THEM KANEKA CORPORATION (JP) 2012-06-28 — — US disclosed
US-8133705-B2 Aminotransferase, gene encoding the same, and method of using them KANEKA CORPORATION (JP) 2012-03-13 — — US disclosed
US-20100285544-A1 Novel aminotransferase, gene encoding the same, and method of using them KANEKA CORPORATION (JP) 2010-11-11 — — US disclosed
EP-1889907-B1 NOVEL AMINO GROUP TRANSFERASE, GENE ENCODING THE SAME AND METHOD OF USING THE SAME KANEKA CORP (JP) 2009-09-02 — — EP disclosed
EP-1889907-A1 NOVEL AMINO GROUP TRANSFERASE, GENE ENCODING THE SAME AND METHOD OF USING THE SAME Kaneka Corporation (JP) 2008-02-20 — — EP disclosed
US-6878708-B2 Imidazotriazinones and the use thereof BAYER AKTIENGESELLSCHAFT (DE) 2005-04-12 — — US disclosed
US-20040097498-A1 Novel imidazotriazinones and the use thereof BAYER AKTIENGESELLSCHAFT (DE) 2004-05-20 — — US disclosed
US-20040030132-A1 New biphenyl and biphenyl-analogous compounds as integrin antagonists BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2004-02-12 — — US disclosed
US-6677360-B2 TREATMENT AND PROPHYLAXIS OF CANCER, ARTERIOSCLEROSIS, RESTENOSIS, OSTEOPOROSIS AND EYE DISORDERS BAYER AKTIENGESELLSCHAFT (DE) 2004-01-13 — — US disclosed
CN-1407986-A Novel imidazotriazinones and the use thereof BAYER AG (DE) 2003-04-02 — — CN disclosed
US-6420396-B1 TREATMENT OF CANCER, ARTERIOSCLEROSIS, RESTENOSIS, OSTEOLYTIC DISORDERS, OPHTHALMIC DISORDERS, AND THEIR USE AS INTEGRIN ANTAGONISTS. INHIBITING ANGIOGENESIS BEIERSDORF AG (DE) 2002-07-16 — — US disclosed
US-20020016461-A1 Biphenyl and biphenyl-analogous compounds as integrin antagonists BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2002-02-07 — — US disclosed
CN-1334801-A Biphenyl and biphenyl-analogous compounds as integrin antagonists BAYER AG (DE) 2002-02-06 — — CN disclosed
US-4853383-A β-blocking substituted imidazoles MERCK & CO., INC. (US) 1989-08-01 — — US disclosed
US-4642311-A β-adrenergic blocking imidazolylphenoxy propanolamines MERCK & CO., INC. (US) 1987-02-10 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040030132-A1 New biphenyl and biphenyl-analogous compounds as integrin antagonists ITGB2, ITGB1, ITGB3 MAOB 1178/4885HTR2C 2063/4885MAOA 2641/4885
US-20040097498-A1 Novel imidazotriazinones and the use thereof CYP4F3, CYP4F2, CYP3A7 MAOB 511/4885HTR2C 3025/4885MAOA 1026/4885
US-20020016461-A1 Biphenyl and biphenyl-analogous compounds as integrin antagonists ITGB1, ITGB2, ITGB3 MAOB 1128/4885HTR2C 1781/4885MAOA 2504/4885
US-20100285544-A1 Novel aminotransferase, gene encoding the same, and method of using them BCAT1, AGXT, ALDH7A1 MAOB 1260/4885HTR2C 4788/4885MAOA 1234/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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