Details-Calcnet-AlzheimerNet

Target name

P04798: Cytochrome P450 1A1

Protein function

Cytochromes P450 are a group of heme-thiolate monooxygenases. In liver microsomes, this enzyme is involved in an NADPH-dependent electron transport pathway. It oxidizes a variety of structurally unrelated compounds, including steroids, fatty acids, and xenobiotics.

Database links

Uniprot primary ID	P04798
PDB ID	4I8V
DrugBank ID	DB01064 DB00655 DB00898 DB00738 DB00755 DB01167 DB00499 DB01169 DB06770 DB00730 DB00203 DB01026 DB00972 DB04841 DB04840 DB00818 DB00381 DB00502 DB00448 DB01095 DB01234 DB00468 DB01092 DB00184 DB00740 DB00613 DB00643 DB00605 DB00201 DB01041 DB00457 DB00633
BioGrid ID	107923
GuidetoPHARMACOLOGY ID
PharmGKB ID	PA27092
KEGG ID	hsa:1543
BioCyc
Entrez Gene (Gene ID)	1543
DIP
STRING	9606ENSP00000369050
MINT
IntAct	P04798
DMDM	117139
BREDNA
Rectome	R-HSA-1989781 R-HSA-2142816 R-HSA-211981 R-HSA-2142670
SignaLink
BindingDB	P04798

Model Performance Metrics

Fingerprint type	F1_CV	AUC_CV	Accuracy_CV	Sensitivity_CV	Specificity_CV	F1_test	AUC_test	Accuracy_test	Sensitivity_test	Specificity_test	Download model
FP2 fingerprints	0.902	0.903	0.901	0.908	0.893	0.857	0.911	0.868	0.938	0.818	Download
MACCS fingerprints	0.808	0.884	0.815	0.776	0.853	0.667	0.811	0.711	0.688	0.727	Download
Daylight fingerprints	0.750	0.772	0.762	0.711	0.813	0.588	0.645	0.632	0.625	0.636	Download
ECFP2 fingerprints	0.821	0.855	0.801	0.908	0.693	0.800	0.911	0.789	1.000	0.636	Download
ECFP4 fingerprints	0.866	0.910	0.854	0.934	0.773	0.800	0.901	0.789	1.000	0.636	Download
ECFP6 fingerprints	0.888	0.917	0.881	0.934	0.827	0.821	0.901	0.816	1.000	0.682	Download

Download datasets

Positive dataset

Negative dataset