Details of the Drug

General Information of Drug (ID: DMI12Y8)

• Drug Name: Nickel chloride
• Synonyms: NICKEL CHLORIDE; Nickel(II) chloride; 7718-54-9; Nickel dichloride; Nickelous chloride; NiCl2; Nickel(2+) chloride; Nickel chloride (NiCl2); dichloronickel; Nickelchloride; Nickel dichloride (nicl2); Nickel(II) chloride (1:2); Nichel(II) chloride; Nickel (II) chloride; Nickel(II) chloride, 98%; Nickel(II) chloride anhydrous; CCRIS 1788; HSDB 860; EINECS 231-743-0; EINECS 253-399-0; NSC 254532; Nickel chloride [Nickel and nickel compounds]; 37211-05-5; dichloro nickel; Nickel(II) chloride, 99.99%, (trace metal basis), anhydrous, po

Indication

Disease Entry	ICD 11	Status	REF
Discovery agent	N.A.	Investigative	[1]

• Drug Type: Small molecular drug
• #Ro5 Violations (Lipinski): 0:
  Molecular Weight; 129.6
  Logarithm of the Partition Coefficient; Not Available
  Rotatable Bond Count; 0
  Hydrogen Bond Donor Count; 0
  Hydrogen Bond Acceptor Count; 0
• Chemical Identifiers:
  Formula: Cl2Ni
  IUPAC Name: dichloronickel
  Canonical SMILES: Cl[Ni]Cl
  InChI: InChI=1S/2ClH.Ni/h2*1H;/q;;+2/p-2
  InChIKey: QMMRZOWCJAIUJA-UHFFFAOYSA-L
• Cross-matching ID:
  PubChem CID: 24385
  ChEBI ID: CHEMBL34887
  CAS Number: 37211-0
  TTD ID: D08MKF
• Drug-Molecule Activity Atlas (DMA)NEW: Click to Jump to the Detailed DMA Information of This Drug

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Voltage-gated calcium channel alpha Cav3.1 (CACNA1G)	TT729IR	CAC1G_HUMAN	Blocker	[1]

Drug Off-Target (DOT)

DOT Name	DOT ID	UniProt ID	Interaction	REF
1,4-alpha-glucan-branching enzyme (GBE1)	OTK2N05B	GLGB_HUMAN	Gene/Protein Processing	[2]
26S proteasome non-ATPase regulatory subunit 12 (PSMD12)	OTWICA51	PSD12_HUMAN	Gene/Protein Processing	[3]
6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 3 (PFKFB3)	OT25JBA3	F263_HUMAN	Gene/Protein Processing	[3]
6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 4 (PFKFB4)	OTQYEXL2	F264_HUMAN	Gene/Protein Processing	[4]
A-kinase anchor protein 11 (AKAP11)	OT7E2FVD	AKA11_HUMAN	Gene/Protein Processing	[3]
Aconitate hydratase, mitochondrial (ACO2)	OTF2UVNV	ACON_HUMAN	Gene/Protein Processing	[5]
Actin, aortic smooth muscle (ACTA2)	OTEDLG8E	ACTA_HUMAN	Gene/Protein Processing	[6]
Actin, cytoplasmic 1 (ACTB)	OT1MCP2F	ACTB_HUMAN	Gene/Protein Processing	[7]
Aldo-keto reductase family 1 member B1 (AKR1B1)	OTRX72TH	ALDR_HUMAN	Gene/Protein Processing	[8]
Alpha-(1,6)-fucosyltransferase (FUT8)	OTJJCVG1	FUT8_HUMAN	Gene/Protein Processing	[3]

References

• [1] T-type calcium channels facilitate insulin secretion by enhancing general excitability in the insulin-secreting beta-cell line, INS-1. Endocrinology. 1997 Sep;138(9):3735-40.
• [2] Nickel-induced 1,4-alpha-glucan branching enzyme 1 up-regulation via the hypoxic signaling pathway. Toxicol Appl Pharmacol. 2004 May 1;196(3):404-9. doi: 10.1016/j.taap.2004.01.012.
• [3] The contact allergen nickel triggers a unique inflammatory and proangiogenic gene expression pattern via activation of NF-kappaB and hypoxia-inducible factor-1alpha. J Immunol. 2007 Mar 1;178(5):3198-207.
• [4] Effects of nickel treatment on H3K4 trimethylation and gene expression. PLoS One. 2011 Mar 24;6(3):e17728. doi: 10.1371/journal.pone.0017728.
• [5] Effect of soluble nickel on cellular energy metabolism in A549 cells. Exp Biol Med (Maywood). 2006 Oct;231(9):1474-80. doi: 10.1177/153537020623100905.
• [6] Reversal of Sp1 transactivation and TGF1/SMAD1 signaling by H(2)S prevent nickel-induced fibroblast activation. Toxicol Appl Pharmacol. 2018 Oct 1;356:25-35. doi: 10.1016/j.taap.2018.07.029. Epub 2018 Jul 26.
• [7] Effect of metals on -actin and total protein synthesis in cultured human intestinal epithelial cells. J Pharmacol Toxicol Methods. 2011 Jan-Feb;63(1):47-58. doi: 10.1016/j.vascn.2010.04.012. Epub 2010 May 6.
• [8] Classification of heavy-metal toxicity by human DNA microarray analysis. Environ Sci Technol. 2007 May 15;41(10):3769-74.