Target name

P42574: Caspase-3


  Protein function

Involved in the activation cascade of caspases responsible for apoptosis execution. At the onset of apoptosis it proteolytically cleaves poly(ADP-ribose) polymerase (PARP) at a '216-Asp-|-Gly-217' bond. Cleaves and activates sterol regulatory element binding proteins (SREBPs) between the basic helix-loop-helix leucine zipper domain and the membrane attachment domain. Cleaves and activates caspase-6, -7 and -9. Involved in the cleavage of huntingtin. Triggers cell adhesion in sympathetic neurons through RET cleavage.

  Database links

Uniprot primary ID P42574
PDB ID 2J31 2J30 2J33 2J32 4EHH 4EHK 4EHL 4EHD 4EHF 4EHA 2XYP 4JQZ 4QUB 4EHN 3PCX 4QUG 4QUD 1CP3 4QUJ 4QUH 4QUI 2XYG 4QUL 1RE1 3PD1 3PD0 3KJF 3DEJ 3DEK 3DEH 3DEI 2DKO 2XZT 2CJY 2CJX 4QTY 3H0E 1PAU 2XZD 4PS0 4JQY 3ITN 2CDR 4DCO 3GJS 4DCJ 4QUE 2C2K 4QUA 4DCP 4PRY
DrugBank ID DB01017
BioGrid ID 107286
GuidetoPHARMACOLOGY ID 1619
PharmGKB ID PA26087
KEGG ID hsa:836
DIP ID DIP-268N
STRING ID 9606.ENSP00000311032
IntAct ID P42574
DMDM 77416852
BRENDA 3.4.22.56
Reactome R-HSA-211227 R-HSA-205025 R-HSA-264870 R-HSA-111465 R-HSA-111464 R-HSA-211736 R-HSA-1474228 R-HSA-2028269 R-HSA-111463 R-HSA-351906 R-HSA-111459 R-HSA-418889
SignaLink
BioCyc
Entrez Gene (Gene ID) 836
BindingDB P42574

  Model Performance Metrics

Fingerprint type Sensitivity SEN_std Specificity SPE_std Accuracy ACC_std F1-score F1-score_std AUC AUC_std MCC MCC_std Download model
FP2 fingerprints 0.779 0.003 0.941 0.005 0.860 0.000 0.850 0.000 0.890 0.000 0.731 0.003 Download
Estate fingerprints 0.809 0.003 0.673 0.005 0.741 0.003 0.760 0.000 0.820 0.000 0.489 0.006 Download
MACCS fingerprints 0.740 0.000 0.828 0.003 0.784 0.005 0.774 0.005 0.850 0.000 0.570 0.000 Download
Daylight fingerprints 0.758 0.004 0.938 0.003 0.848 0.004 0.830 0.000 0.840 0.000 0.701 0.003 Download
ECFP2 fingerprints 0.832 0.004 0.948 0.004 0.890 0.000 0.884 0.005 0.960 0.000 0.786 0.005 Download
ECFP4 fingerprints 0.805 0.005 0.975 0.000 0.890 0.000 0.880 0.000 0.970 0.000 0.800 0.000 Download
ECFP6 fingerprints 0.780 0.000 1.000 0.000 0.890 0.000 0.874 0.005 0.960 0.000 0.794 0.005 Download

  Download datasets

Positive dataset Negative dataset


Copyright @ 2012-2014 Computational Biology & Drug Design Group,
School of Pharmaceutical Sciences, Central South University. All rights reserved.

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