iGMDRD613

Canonical SMILES: CCC1=CC=CC=C1NC(=O)CSC(=O)NNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)OC(C)(C)C

InChI: InChI=1S/C27H33N5O5S/c1-5-17-10-6-8-12-20(17)29-23(33)16-38-26(36)32-31-24(34)22(30-25(35)37-27(2,3)4)14-18-15-28-21-13-9-7-11-19(18)21/h6-13,15,22,28H,5,14,16H2,1-4H3,(H,29,33)(H,30,35)(H,31,34)(H,32,36)/t22-/m1/s1

InChI Key: OTIWAYTTYNFEKL-JOCHJYFZSA-N

Standard NameCHEMBLPubchem CIDDrug StatusDrug Type
CHEMBL258148CHEMBL258148 44456200AloneSmall Molecule

Drug Targets:

CTSL

Drug-model tissue-cancer distribution: Bubble Plot

Drug-gene pathway enrichments

Drug-gene GO enrichments

Drug-Gene: Aster Plot


Gene IDGene NameModel Num.
7514XPO11
10987COPS51
21ABCA32
2200FBN11
3708ITPR13
55215FANCI3
9475ROCK23
577ADGRB31
5159PDGFRB1
7373COL14A11
9759HDAC41
5108PCM13
6092ROBO22
7994KAT6A1
54658UGT1A11
51366UBR51
57144PAK52
1000CDH21
1956EGFR3
673BRAF3
7301TYRO31
115701ALPK21
7248TSC11
57448BIRC61
23139MAST23
2065ERBB31
142PARP12
23072HECW11
5624PROC2

Gene in drug-gene network: Network Plot

Models in CHEMBL258148

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