Guanidine

Guanidine

SCHEMBL324301

CCc1c(O)cccc1-c1ccccc1.N=C(N)N

nearest known ligand 0.47

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 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
BCL2L1 Q07817 1/20 0.47
HSD17B10 Q99714 1/20 0.47
LMNA P02545 1/20 0.41
USP7 Q93009 2/20 0.40
BACE1 P56817 2/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
PLAU P00749 3/20 0.38
PLAT P00750 3/20 0.38
F9 P00740 1/20 0.38
BRD4 O60885 1/20 0.37
NR1I2 O75469 1/20 0.37
SMARCA2 P51531 1/20 0.37
SMARCA4 P51532 1/20 0.37
PBRM1 Q86U86 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL2683682 0.91 ALDH1A1 (0.56) ALDH1A1HPGDBCL2L1HSD17B10USP7
Ammonia Solution, Strong SCHEMBL324959 0.90 ALDH1A1 (0.54) ALDH1A1HPGDBCL2L1HSD17B10USP7
Water SCHEMBL28266485 0.90 ALDH1A1 (0.54) ALDH1A1HPGDBCL2L1HSD17B10USP7
SCHEMBL323997 0.90 ALDH1A1 (0.54) ALDH1A1HPGDBCL2L1HSD17B10USP7
Formaldehyde SCHEMBL29110546 0.86 ALDH1A1 (0.50) ALDH1A1HPGDBCL2L1HSD17B10LMNA
SCHEMBL21694265 0.79 USP7 (0.45) ALDH1A1HPGDBCL2L1HSD17B10USP7
SCHEMBL16527875 0.78 GABRA1 (0.42) ALDH1A1HPGDBCL2L1HSD17B10LMNA
SCHEMBL9806251 0.78 PDCD1 (0.47) ALDH1A1HPGDBCL2L1HSD17B10USP7
SCHEMBL528810 0.77 BCL2L1 (0.52) ALDH1A1HPGDBCL2L1HSD17B10USP7
SCHEMBL15911092 0.77 ALDH1A1 (0.56) ALDH1A1HPGDBCL2L1HSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120167451-A1 PYROLYSIS OIL BASED FUEL AND METHOD OF PRODUCTION NEW GENERATION BIOFUELS HOLDINGS, INC. (US) 2012-07-05 US disclosed
WO-2012006316-A1 PYROLYSIS OIL BASED FUEL AND METHOD OF PRODUCTION NEW GENERATION BIOFUELS HOLDINGS, INC. (US) 2012-01-12 WO disclosed
US-20100037513-A1 Biofuel Composition and Method of Producing a Biofuel NEW GENERATION BIOFUELS, INC. (US) 2010-02-18 US disclosed
EP-2010631-A2 BIOFUEL COMPOSITION AND METHOD OF PRODUCING A BIOFUEL New Generation Biofuels, Inc. (US) 2009-01-07 EP disclosed
WO-2007127059-A2 BIOFUEL COMPOSITION AND METHOD OF PRODUCING A BIOFUEL NEW GENERATION BIOFUELS, INC. (US) 2007-11-08 WO disclosed