Guanidino Acetate

Guanidino Acetate

SCHEMBL939900

N=C(N)NCC(=O)[O-].O=P([O-])(O)O.[Na+].[Na+]

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

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

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.36
CA12 O43570 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
CA4 P22748 3/20 0.33
CA5A P35218 2/20 0.32
CA5B Q9Y2D0 2/20 0.32
LMNA P02545 1/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
SLC34A1 Q06495 1/20 0.31

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
Guanidino Acetate SCHEMBL3229844 0.89
Guanidino Acetate SCHEMBL28334594 0.85 CA12 (0.43) CA1CA12CA2CA9CA4
Guanidino Acetate SCHEMBL29624818 0.85
Guanidino Acetate SCHEMBL28334592 0.85 CA12 (0.43) CA1CA12CA2CA9CA4
Guanidino Acetate SCHEMBL28332505 0.85 CA12 (0.43) CA1CA12CA2CA9CA4
Guanidino Acetate SCHEMBL28334590 0.85 CA12 (0.43) CA1CA12CA2CA9CA4
Guanidino Acetate SCHEMBL1097960 0.85 CA12 (0.43) CA1CA12CA2CA9CA4
Guanidino Acetate SCHEMBL29624828 0.85 CA12 (0.43) CA1CA12CA2CA9CA4
Guanidino Acetate SCHEMBL28334591 0.85
Guanidino Acetate SCHEMBL28700113 0.80 CA1 (0.36) CA1CA12CA2CA9CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120141391-A1 Use of creatine or creatine compounds for skin preservation AVICENA GROUP, INC. (US) 2012-06-07 US disclosed
EP-2327404-A1 Use of creatine or creatine analogs for the treatment of diseases of the nervous system Avicena Group, Inc. (US) 2011-06-01 EP disclosed
US-20110085993-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION AVICENA GROUP, INC. (US) 2011-04-14 US disclosed
US-20110021632-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION AVICENA GROUP, INC. (US) 2011-01-27 US disclosed
US-20110008272-A1 Use of Creatine or Creatine Compounds for Skin Preservation AVICENA GROUP, INC. (US) 2011-01-13 US disclosed
US-20100329997-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION AVICENA GROUP, INC. (US) 2010-12-30 US disclosed
US-20100303840-A1 USE OF CREATINE OR CREATINE ANALOGS FOR THE TREATMENT OF DISEASES OF THE NERVOUS SYSTEM AVICENA GROUP, INC. (US) 2010-12-02 US disclosed
US-20100226870-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION AVICENA GROUP, INC. (US) 2010-09-09 US disclosed
US-20090105196-A1 USE OF CREATINE COMPOUNDS TO TREAT DERMATITIS AVICENA GROUP, INC. 2009-04-23 US disclosed
US-20090005450-A1 Use of creatine compounds for the treatment of eye disorders AVICENA GROUP, INC. 2009-01-01 US disclosed
US-20020049253-A1 Use of creatine or creatine compounds for skin preservation AVICENA GROUP, INC. 2002-04-25 US disclosed
EP-1198230-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION Avicena Group, Inc. (US) 2002-04-24 EP disclosed
WO-2001055719-A2 DIAGNOSTIC KIT FOR DETECTING CREATINE LEVELS FAL DIAGNOSTICS (US) 2001-08-02 WO disclosed
US-6242491-B1 ADMINISTERING CREATINE PHOSPHATE FOR WRINKLE, AGING, AND SOLAR RADIATION RESISTANCE AND AS FREE RADICAL SCAVENGER LIBRARY PHARMA, INC. 2001-06-05 US disclosed
EP-1065931-A1 COMPOSITIONS CONTAINING A COMBINATION OF A CREATINE COMPOUND AND A SECOND AGENT Avicena Group, Inc. (US) 2001-01-10 EP disclosed
WO-2001000212-A1 USE OF CREATINE OR CREATINE ANALOGS FOR THE PREVENTION AND TREATMENT OF TRANSMISSIBLE SPONGIFORM ENCEPHALOPATHIES AVICENA GROUP, INC. (US) 2001-01-04 WO disclosed
WO-2001000203-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION AVICENA GROUP, INC. (US) 2001-01-04 WO disclosed
WO-1999051097-A1 COMPOSITIONS CONTAINING A COMBINATION OF A CREATINE COMPOUND AND A SECOND AGENT AVICENA GROUP, INC. (US) 1999-10-14 WO disclosed
EP-0804183-A1 USE OF CREATINE OR CREATINE ANALOGS FOR THE TREATMENT OF DISEASES OF THE NERVOUS SYSTEM AVICENDA GROUP, INC. (US) 1997-11-05 EP disclosed
WO-1996014063-A1 USE OF CREATINE OR CREATINE ANALOGS FOR THE TREATMENT OF DISEASES OF THE NERVOUS SYSTEM AVICENA GROUP, INC. (US) 1996-05-17 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 (10 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-20110008272-A1 Use of Creatine or Creatine Compounds for Skin Preservation PC, CKMT1A; CKMT1B, CHEK1 CA1 3597/4885CA12 2738/4885CA2 1291/4885
US-20120141391-A1 Use of creatine or creatine compounds for skin preservation PC, CKMT1A; CKMT1B, CHEK1 CA1 3597/4885CA12 2738/4885CA2 1291/4885
US-20100329997-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION PC, CKMT1A; CKMT1B, CHEK1 CA1 3597/4885CA12 2738/4885CA2 1291/4885
US-20090105196-A1 USE OF CREATINE COMPOUNDS TO TREAT DERMATITIS CKMT1A; CKMT1B, CRAT, LRAT CA1 2758/4885CA12 1590/4885CA2 1678/4885
US-20100303840-A1 USE OF CREATINE OR CREATINE ANALOGS FOR THE TREATMENT OF DISEASES OF THE NERVOUS SYSTEM CKMT1A; CKMT1B, PC, PCK2 CA1 1827/4885CA12 3250/4885CA2 2538/4885
US-20110021632-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION PC, CKMT1A; CKMT1B, CHEK1 CA1 3597/4885CA12 2738/4885CA2 1291/4885
US-20100226870-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION PC, CKMT1A; CKMT1B, CHEK1 CA1 3597/4885CA12 2738/4885CA2 1291/4885
US-20020049253-A1 Use of creatine or creatine compounds for skin preservation PC, CKMT1A; CKMT1B, CHEK1 CA1 3597/4885CA12 2738/4885CA2 1291/4885
US-20110085993-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION PC, CKMT1A; CKMT1B, CHEK1 CA1 3597/4885CA12 2738/4885CA2 1291/4885
US-20090005450-A1 Use of creatine compounds for the treatment of eye disorders ALDH1A2, RXFP1, RBP4 CA1 3445/4885CA12 2550/4885CA2 632/4885

“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.