Arginine

Arginine

SCHEMBL423342

N=C(N)NCCC[C@H](N)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O.O=C(O)O.[CaH2]

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACE

The experimentally established mechanism targets of Arginine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OTC P00480 1/20 0.53
DDAH1 O94760 4/20 0.49
NOS2 P35228 6/20 0.47
NOS1 P29475 6/20 0.47
NOS3 P29474 5/20 0.47
GSR P00390 1/20 0.46
CYP2C19 P33261 2/20 0.44
CYP1A2 P05177 2/20 0.44
TSHR P16473 2/20 0.44
GLA P06280 1/20 0.44
NFKB1 P19838 1/20 0.44
APEX1 P27695 1/20 0.44
KMT2A Q03164 2/20 0.42
ALOX15 P16050 1/20 0.42
BLM P54132 1/20 0.42
PMP22 Q01453 1/20 0.42
MEN1 O00255 1/20 0.42
ARG2 P78540 4/20 0.42
ARG1 P05089 3/20 0.42
CYP3A4 P08684 1/20 0.41

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
Arginine SCHEMBL16486916 1.00 OTC (0.53) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL28165841 1.00 OTC (0.53) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL15890 0.98 OTC (0.54) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL15889 0.98 OTC (0.54) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL27996908 0.98 OTC (0.54) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL28725103 0.98 OTC (0.54) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL2729038 0.98 OTC (0.54) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL4331631 0.98 OTC (0.54) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL1128244 0.98 OTC (0.54) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL4332185 0.98 OTC (0.54) OTCDDAH1NOS2NOS1NOS3

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102625690-B Oral compositions for treating tooth sensitivity and methods of use and manufacture thereof COLGATE PALMOLIVE CO 2014-11-26 CN claimed
CN-102625690-A Oral compositions for treating tooth sensitivity and methods of use and manufacture thereof COLGATE PALMOLIVE CO 2012-08-01 CN claimed
EP-2413885-A2 ORAL COMPOSITIONS FOR TREATING TOOTH SENSITIVITY AND METHODS OF USE AND MANUFACTURE THEREOF Colgate-Palmolive Company (US) 2012-02-08 EP claimed
US-20120020899-A1 ORAL COMPOSITIONS FOR TREATING TOOTH SENSITIVITY AND METHODS OF USE AND MANUFACTURE THEREOF COLGATE-PALMOLIVE COMPANY (US) 2012-01-26 US claimed
WO-2010115041-A2 ORAL COMPOSITIONS FOR TREATING TOOTH SENSITIVITY AND METHODS OF USE AND MANUFACTURE THEREOF COLGATE-PALMOLIVE COMPANY (US) 2010-10-07 WO claimed
EP-2432444-B1 ORAL COMPOSITIONS CONTAINING POLYGUANIDINIUM COMPOUNDS AND METHODS OF MANUFACTURE AND USE THEREOF COLGATE PALMOLIVE CO (US) 2017-08-23 EP disclosed
CN-105412143-A Oral cavity composition containing polyguanidine compounds and preparation and application method of oral cavity composition COLGATE PALMOLIVE CO 2016-03-23 CN disclosed
CN-102625690-B Oral compositions for treating tooth sensitivity and methods of use and manufacture thereof COLGATE PALMOLIVE CO 2014-11-26 CN disclosed
US-8758729-B2 Oral compositions containing polyguanidinium compounds and methods of manufacture and use thereof COLGATE-PALMOLIVE COMPANY (US) 2014-06-24 US disclosed
CN-102625690-A Oral compositions for treating tooth sensitivity and methods of use and manufacture thereof COLGATE PALMOLIVE CO 2012-08-01 CN disclosed
CN-102427795-A Oral compositions containing polyguanidine compounds and methods of making and using the same COLGATE PALMOLIVE CO 2012-04-25 CN disclosed
EP-2432444-A1 ORAL COMPOSITIONS CONTAINING POLYGUANIDINIUM COMPOUNDS AND METHODS OF MANUFACTURE AND USE THEREOF Colgate-Palmolive Company (US) 2012-03-28 EP disclosed
US-20120045400-A1 ORAL COMPOSITIONS CONTAINING POLYGUANIDINIUM COMPOUNDS AND METHODS OF MANUFACTURE AND USE THEREOF COLGATE-PALMOLIVE COMPANY (US) 2012-02-23 US disclosed
EP-2413885-A2 ORAL COMPOSITIONS FOR TREATING TOOTH SENSITIVITY AND METHODS OF USE AND MANUFACTURE THEREOF Colgate-Palmolive Company (US) 2012-02-08 EP disclosed
US-20120020899-A1 ORAL COMPOSITIONS FOR TREATING TOOTH SENSITIVITY AND METHODS OF USE AND MANUFACTURE THEREOF COLGATE-PALMOLIVE COMPANY (US) 2012-01-26 US disclosed
WO-2010134904-A1 ORAL COMPOSITIONS CONTAINING POLYGUANIDINIUM COMPOUNDS AND METHODS OF MANUFACTURE AND USE THEREOF COLGATE-PALMOLIVE COMPANY (US) 2010-11-25 WO disclosed
WO-2010115041-A2 ORAL COMPOSITIONS FOR TREATING TOOTH SENSITIVITY AND METHODS OF USE AND MANUFACTURE THEREOF COLGATE-PALMOLIVE COMPANY (US) 2010-10-07 WO 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 (1 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-20120045400-A1 ORAL COMPOSITIONS CONTAINING POLYGUANIDINIUM COMPOUNDS AND METHODS OF MANUFACTURE AND USE THEREOF SRM, GMPS, PARG OTC 159/4885DDAH1 2839/4885NOS2 394/4885

“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.