Guanidine

Guanidine

SCHEMBL5263395

Cc1ccc2c(c1)CCCC2(C)C.N=C(N)N

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2

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

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.41
RXRB P28702 2/20 0.41
RXRG P48443 2/20 0.41
SIGMAR1 Q99720 2/20 0.41
ALDH1A1 P00352 3/20 0.39
CYP3A4 P08684 1/20 0.39
SIRT1 Q96EB6 1/20 0.36
KDM1A O60341 5/20 0.35
ADRA2A P08913 1/20 0.35
PARP1 P09874 1/20 0.34
PGR P06401 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL213183 0.90 SIGMAR1 (0.47) RXRARXRBRXRGSIGMAR1ALDH1A1
Urea SCHEMBL8151835 0.89 RXRA (0.46) RXRARXRBRXRGSIGMAR1ALDH1A1
Ammonia Solution, Strong SCHEMBL8159676 0.89 SIGMAR1 (0.46) RXRARXRBRXRGSIGMAR1ALDH1A1
Phosphine SCHEMBL5925750 0.89 SIGMAR1 (0.46) RXRARXRBRXRGSIGMAR1ALDH1A1
Bromide SCHEMBL4618934 0.89 SIGMAR1 (0.46) RXRARXRBRXRGSIGMAR1ALDH1A1
Iodide SCHEMBL9192873 0.89 SIGMAR1 (0.46) RXRARXRBRXRGSIGMAR1ALDH1A1
Hydrochloric Acid SCHEMBL9190644 0.89 SIGMAR1 (0.48) RXRARXRBRXRGSIGMAR1ALDH1A1
Sulfuric Acid SCHEMBL11708924 0.84 RXRA (0.44) RXRARXRBRXRGSIGMAR1ALDH1A1
Ethylene Glycol SCHEMBL10592333 0.84 SIGMAR1 (0.44) RXRARXRBRXRGSIGMAR1ALDH1A1
Urethane SCHEMBL9284788 0.82 RXRA (0.41) RXRARXRBRXRGSIGMAR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1815861-A2 Ionene polymers and their use as antimicrobial agents Geltex Pharmaceuticals, Inc. (US) 2007-08-08 EP disclosed
US-20070025954-A1 Ionene polymers and their use as antimicrobial agents FITZPATRICK RICHARD J 2007-02-01 US disclosed
US-20060002888-A1 Polyionenes for treating infections associated with cystic fibrosis GENZYME CORPORATION (US) 2006-01-05 US disclosed
US-20060002889-A1 Polyionene polymers with hydrolyzable linkages GENZYME CORPORATION (US) 2006-01-05 US disclosed
US-6955806-B2 Ionene polymers and their use as antimicrobial agents GENZYME CORPORATION (US) 2005-10-18 US disclosed
WO-2004045629-A1 POLYIONENES FOR TREATING INFECTIONS ASSOCIATED WITH CYSTIC FIBROSIS GENZYME CORPORATION (US) 2004-06-03 WO disclosed
WO-2004046223-A2 POLYIONENE POLYMERS WITH HYDROLYZABLE LINKAGES GENZYME CORPORATION (US) 2004-06-03 WO disclosed
EP-1372675-A2 IONENE POLYMERS AND THEIR USE AS ANTIMICROBIAL AGENTS Geltex Pharmaceuticals, Inc. (US) 2004-01-02 EP disclosed
US-20030031644-A1 Ionene polymers and their use as antimicrobial agents GELTEX PHARMACEUTICALS, INC. (US) 2003-02-13 US disclosed
US-20030021761-A1 Ionene polymers and their use in treating mucositis GELTEX PHARMACEUTICALS, INC. (US) 2003-01-30 US disclosed
WO-2002080939-A2 IONENE POLYMERS AND THEIR USE AS ANTIMICROBIAL AGENTS GENZYME CORPORATION (US) 2002-10-17 WO disclosed
WO-2002056895-A2 IONENE POLYMERS AND THEIR USE IN TREATING MUCOSITIS GENZYME CORPORATION (US) 2002-07-25 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 (5 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-20030031644-A1 Ionene polymers and their use as antimicrobial agents PIGS, PCNA, ELANE RXRA 4842/4885RXRB 4874/4885RXRG 4827/4885
US-20060002889-A1 Polyionene polymers with hydrolyzable linkages POLI, IDE, MGAM RXRA 4136/4885RXRB 4538/4885RXRG 4018/4885
US-20060002888-A1 Polyionenes for treating infections associated with cystic fibrosis CFTR, ELANE, POLI RXRA 3118/4885RXRB 3338/4885RXRG 3046/4885
US-20070025954-A1 Ionene polymers and their use as antimicrobial agents PIEZO1, PIGS, PCNA RXRA 4809/4885RXRB 4858/4885RXRG 4799/4885
US-20030021761-A1 Ionene polymers and their use in treating mucositis ELANE, PIGS, MRE11 RXRA 2608/4885RXRB 3362/4885RXRG 2385/4885

“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.