Tilarginine

Tilarginine

SCHEMBL2229626

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

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

NOS1NOS2NOS3

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

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOS1 known ✓ P29475 4/20 0.45
NOS2 known ✓ P35228 4/20 0.45
NOS3 known ✓ P29474 3/20 0.45
OTC P00480 1/20 0.50
DDAH1 O94760 1/20 0.43
GSR P00390 1/20 0.43
ARG2 P78540 4/20 0.42
BLM P54132 1/20 0.41
DPP7 Q9UHL4 1/20 0.40
MEN1 O00255 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
NOD1 Q9Y239 1/20 0.40
ARG1 P05089 3/20 0.40
PMP22 Q01453 1/20 0.40

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
Tilarginine SCHEMBL315843 0.98 OTC (0.51) OTCNOS1NOS2NOS3DDAH1
Tilarginine SCHEMBL12028766 0.98 OTC (0.51) OTCNOS1NOS2NOS3DDAH1
Tilarginine SCHEMBL6370536 0.98 OTC (0.51) OTCNOS1NOS2NOS3DDAH1
Tilarginine SCHEMBL1321022 0.95 OTC (0.49) OTCNOS1NOS2NOS3DDAH1
SCHEMBL1006081 0.93 GSR (0.47) OTCNOS1NOS2NOS3DDAH1
SCHEMBL14423587 0.93 GSR (0.47) OTCNOS1NOS2NOS3DDAH1
SCHEMBL4393876 0.88 PMP22 (0.43) OTCNOS1NOS2NOS3GSR
SCHEMBL29533865 0.88 PMP22 (0.43) OTCNOS1NOS2NOS3GSR
Hydrochloric Acid SCHEMBL30271216 0.85 OTC (0.49) OTCNOS1NOS2NOS3DDAH1
SCHEMBL19608041 0.85 DPP7 (0.41) OTCNOS1NOS2NOS3DDAH1

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
EP-0651741-A1 N?G -MONOMETHYL-L-ARGININE HYDROCHLORIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF SEPTIC SHOCK. WELLCOME FOUND (GB) 1995-05-10 EP claimed
WO-1994002453-A1 NG-MONOMETHYL-L-ARGININE HYDROCHLORIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF SEPTIC SHOCK THE WELLCOME FOUNDATION LIMITED (GB) 1994-02-03 WO claimed
US-9533056-B2 Dipeptide-based prodrug linkers for aliphatic amine-containing drugs ASCENDIS PHARMA AS (DK) 2017-01-03 US disclosed
EP-2525830-B1 DIPEPTIDE-BASED PRODRUG LINKERS FOR ALIPHATIC AMINE-CONTAINING DRUGS ASCENDIS PHARMA AS (DK) 2016-05-11 EP disclosed
US-20150202317-A1 DIPEPTIDE-BASED PRODRUG LINKERS FOR ALIPHATIC AMINE-CONTAINING DRUGS ASCENDIS PHARMA AS (DK) 2015-07-23 US disclosed
US-9062094-B2 Dipeptide-based prodrug linkers for aliphatic amine-containing drugs ASCENDIS PHARMA AS (DK) 2015-06-23 US disclosed
US-8748177-B2 Compositions for proliferation of cells and related methods THE HOSPITAL FOR SICK CHILDREN (CA) 2014-06-10 US disclosed
US-8680270-B2 Metallo-oxidoreductase inhibitors using metal binding moieties in combination with targeting moieties VIAMET PHARMACEUTICALS, INC. (US) 2014-03-25 US disclosed
EP-2086546-B1 METALLO-OXIDOREDUCTASE INHIBITORS USING METAL BINDING MOIETIES IN COMBINATION WITH TARGETING MOIETIES VIAMET PHARMACEUTICALS INC (US) 2013-07-10 EP disclosed
US-20130053301-A1 DIPEPTIDE-BASED PRODRUG LINKERS FOR ALIPHATIC AMINE-CONTAINING DRUGS ASCENDIS PHARMA A/S (DK) 2013-02-28 US disclosed
US-20110301105-A1 COMPOSITIONS FOR PROLIFERATION OF CELLS AND RELATED METHODS THE HOSPITAL FOR SICK CHILDREN (CA) 2011-12-08 US disclosed
US-5883130-A Ng-monomethyl-l-arginine hydrochloride derivatives and their use in the treatment of septic shock GLAXO WELLCOME INC. (US) 1999-03-16 US disclosed
US-5856565-A Ng-monomethyl-l-argine hydrochloride derivatives and their use in the treatment of septic shock GLAXO WELLCOME, INC. (US) 1999-01-05 US disclosed
US-5767312-A NG -monomethyl-L-arginine hydrochloride derivatives and their use in the treatment of septic shock GLAXO WELLCOME, INC. (US) 1998-06-16 US disclosed
WO-1997030972-A1 PROCESS FOR THE PREPARATION OF NG-MONOMETHYL-L-ARGININE HYDROCHLORIDE GLAXO GROUP LIMITED (GB) 1997-08-28 WO disclosed
EP-0651741-B1 NG-MONOMETHYL-L-ARGININE HYDROCHLORIDE DERIVATIVES AND PROCESS FOR THEIR PREPARATION WELLCOME FOUND (GB) 1997-01-29 EP disclosed
EP-0651741-B1 NG-MONOMETHYL-L-ARGININE HYDROCHLORIDE DERIVATIVES AND PROCESS FOR THEIR PREPARATION WELLCOME FOUND (GB) 1997-01-29 EP disclosed
EP-0651741-A1 N?G -MONOMETHYL-L-ARGININE HYDROCHLORIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF SEPTIC SHOCK. WELLCOME FOUND (GB) 1995-05-10 EP disclosed
CN-1087624-A Arginine derivative WELLCOME FOUND (GB) 1994-06-08 CN disclosed
WO-1994002453-A1 NG-MONOMETHYL-L-ARGININE HYDROCHLORIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF SEPTIC SHOCK THE WELLCOME FOUNDATION LIMITED (GB) 1994-02-03 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 (3 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-20150202317-A1 DIPEPTIDE-BASED PRODRUG LINKERS FOR ALIPHATIC AMINE-CONTAINING DRUGS DNPEP, PEPD, DAO NOS1 1941/4885NOS2 1649/4885NOS3 1784/4885
US-20130053301-A1 DIPEPTIDE-BASED PRODRUG LINKERS FOR ALIPHATIC AMINE-CONTAINING DRUGS DNPEP, PEPD, DAO NOS1 1941/4885NOS2 1649/4885NOS3 1784/4885
US-20110301105-A1 COMPOSITIONS FOR PROLIFERATION OF CELLS AND RELATED METHODS MKI67, KRT18, PROX1 NOS1 3060/4885NOS2 3344/4885NOS3 3010/4885

“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.