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iGMDRD270

Canonical SMILES: CCC1C(=O)N(CC(=O)N(C(C(=O)NC(C(=O)N(C(C(=O)NC(C(=O)NC(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N1)C(C(C)CC=CC)O)C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)C(C)C)CC(C)C)C)C

InChI: InChI=1S/C62H111N11O12/c1-25-27-28-40(15)52(75)51-56(79)65-43(26-2)58(81)67(18)33-48(74)68(19)44(29-34(3)4)55(78)66-49(38(11)12)61(84)69(20)45(30-35(5)6)54(77)63-41(16)53(76)64-42(17)57(80)70(21)46(31-36(7)8)59(82)71(22)47(32-37(9)10)60(83)72(23)50(39(13)14)62(85)73(51)24/h25,27,34-47,49-52,75H,26,28-33H2,1-24H3,(H,63,77)(H,64,76)(H,65,79)(H,66,78)/b27-25+/t40-,41+,42-,43+,44+,45+,46+,47+,49+,50+,51+,52-/m1/s1

InChI Key: PMATZTZNYRCHOR-CGLBZJNRSA-N

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Standard Name	CHEMBL	Pubchem CID	KEGG Drug ID	DRUGBANK ID	Drug Status	Drug targets (TTD)	Drug Type
Standard NameCiclosporin CHEMBLCHEMBL160 Pubchem CID5284370 KEGG Drug IDD00184 DRUGBANK IDDB00091 Drug StatusAlone Drug targets (TTD)DNC001177 Drug TypeSmall Molecule

Drug Class:

Amino Acids, Peptides, and Proteins Anti-Infective Agents Anti-Inflammatory Agents Anti-inflammatory Agents, Miscellaneous Antifungal Agents Antineoplastic and Immunomodulating Agents Antirheumatic Agents BCRP/ABCG2 Inhibitors BSEP/ABCB11 Inhibitors Calcineurin Inhibitor Immunosuppressant Calcineurin Inhibitors Combined Inhibitors of CYP3A4 and P-glycoprotein Combined Inhibitors of CYP3A4 and P-glycoprotein (Moderate)Cyclosporins Cytochrome P-450 CYP3A Inhibitors Cytochrome P-450 CYP3A Substrates Cytochrome P-450 CYP3A4 Inhibitors Cytochrome P-450 CYP3A4 Inhibitors (moderate)Cytochrome P-450 CYP3A4 Substrates Cytochrome P-450 CYP3A5 Substrates Cytochrome P-450 CYP3A7 Substrates Cytochrome P-450 Enzyme Inducers Cytochrome P-450 Enzyme Inhibitors Dermatologicals Enzyme Inhibitors Immunologic Factors Immunosuppressive Agents Macrocyclic Compounds Ophthalmologicals P-glycoprotein/ABCB1 Inducers P-glycoprotein/ABCB1 Inhibitors P-glycoprotein/ABCB1 Substrates Peptides Peptides, Cyclic Polycyclic Compounds Sensory Organs

Drug Targets:

CAMLG (P49069)PPP3R2 (Q96LZ3)PPIA (P62937)PPIF (P30405)PPID

Drug Pathways:

MAPK signaling pathway Cellular senescence Osteoclast differentiation Natural killer cell mediated cytotoxicity Th1 and Th2 cell differentiation Th17 cell differentiation T cell receptor signaling pathway

Drug Synonyms:

Cyclosporine (USP)Ciclosporin (JP17)Gengraf (TN)Neoral (TN)Restasis (TN)Sandimmune (TN)

Drug-model tissue-cancer distribution: Bubble Plot

Drug-gene pathway enrichments

Drug-gene GO enrichments

Drug-Gene: Aster Plot

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Gene ID	Gene Name	Model Num.
331	XIAP	3
1147	CHUK	2
7837	PXDN	5
21	ABCA3	3

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Gene in drug-gene network: Network Plot

Models in Ciclosporin

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	Model	Level	Reference ID	Tissue	Cancer	Drug	Clinical Response	Source
No matching records found

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