Guanidine

SCHEMBL28645150

CCCC[C@@]1(n2ccc(N)nc2=O)O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.N=C(N)N

nearest known ligand 0.54

Known targets — ChEMBL curated mechanism

KCNA1 KCNA10 KCNA2 KCNA3 KCNA4 KCNA5 KCNA6 KCNA7 KCNB1 KCNB2 KCNC1 KCNC2 KCNC3 KCNC4 KCND1 KCND2 KCND3 KCNF1 KCNG1 KCNG2 KCNG3 KCNG4 KCNH1 KCNH2 KCNH3 KCNH4 KCNH5 KCNH6 KCNH7 KCNH8 KCNQ1 KCNQ2 KCNQ3 KCNQ4 KCNQ5 KCNS1 KCNS2 KCNS3 KCNV1 KCNV2

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 5)

	gene	UniProt	supporting neighbours	confidence
▸	P2RY2	P41231	11/20	0.42

▸	P2RY6	Q15077	8/20	0.42

▸	POLG	P54098	1/20	0.41

▸	P2RY4	P51582	5/20	0.40

▸	POLB	P06746	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.

Compound	similarity	top predicted	shared targets
SCHEMBL28633711	0.97	P2RY2 (0.44)	P2RY2P2RY6POLGP2RY4POLB
SCHEMBL10903450	0.87	POLG (0.45)	P2RY2P2RY6POLGP2RY4POLB
SCHEMBL30140872	0.86	POLG (0.49)	P2RY2P2RY6POLGP2RY4POLB
Guanidine SCHEMBL28644548	0.83	LMNA (0.43)	POLB
SCHEMBL28518605	0.81	POLG (0.47)	P2RY2P2RY6POLGP2RY4POLB
SCHEMBL28633723	0.80	POLG (0.44)	P2RY2P2RY6POLGP2RY4POLB
SCHEMBL3635669	0.80	POLG (0.46)	P2RY2P2RY6POLGP2RY4POLB
SCHEMBL28645147	0.79	LMNA (0.46)	POLB
SCHEMBL18394211	0.79	P2RY2 (0.51)	P2RY2P2RY6POLGP2RY4POLB
SCHEMBL26102705	0.78	POLG (0.51)	P2RY2P2RY6POLGP2RY4POLB

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-113423877-A	Mutant tRNAs for codon expansion	中外制药株式会社	2021-09-21	—	—	CN	disclosed