Details-Calcnet-TargetNet

Target name

P15121: Aldose reductase

Protein function

Catalyzes the NADPH-dependent reduction of a wide variety of carbonyl-containing compounds to their corresponding alcohols with a broad range of catalytic efficiencies.

Database links

Uniprot primary ID	P15121
PDB ID	4PUW 1ADS 4PUU 3S3G 1T41 2F2K 3MC5 4QX4 3T42 2IQ0 1PWL 1PWM 1ABN 4LB3 4PRT 4LB4 2INZ 1MAR 1Z8A 4QR6 3M64 4NKC 1XGD 4GQ0 1US0 2INE 2IPW 1EF3 2FZD 4IGS 4LBR 4LBS 2FZ8 2FZ9 3MB9 3G5E 3BCJ 2PZN 1Z89 2AGT 2PEV 3ONB 3ONC 4PR4 3Q67 1Z3N 4PRR 2DUX 2DUZ 3DN5 3LD5
DrugBank ID	DB00605
BioGrid ID	106732
GuidetoPHARMACOLOGY ID	2768
PharmGKB ID	PA24675
KEGG ID	hsa:231
DIP ID
STRING ID	9606.ENSP00000285930
IntAct ID	P15121
DMDM	113596
BRENDA	1.1.1.21 1.1.1.188
Reactome	R-HSA-5652227 R-HSA-196108
SignaLink
BioCyc	MetaCyc:HS01502-MONOMER
Entrez Gene (Gene ID)	231
BindingDB	P15121

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	0.695	0.010	0.993	0.000	0.844	0.005	0.816	0.005	0.970	0.000	0.717	0.007	Download
Estate fingerprints	0.765	0.005	0.861	0.005	0.813	0.005	0.804	0.005	0.900	0.000	0.627	0.009	Download
MACCS fingerprints	0.916	0.005	0.882	0.005	0.899	0.003	0.900	0.000	0.969	0.003	0.795	0.005	Download
Daylight fingerprints	0.707	0.005	0.929	0.005	0.818	0.004	0.791	0.003	0.840	0.000	0.647	0.005	Download
ECFP2 fingerprints	0.978	0.004	0.944	0.005	0.961	0.003	0.962	0.004	0.990	0.000	0.925	0.005	Download
ECFP4 fingerprints	0.966	0.005	0.986	0.000	0.976	0.005	0.976	0.005	1.000	0.000	0.949	0.006	Download
ECFP6 fingerprints	0.928	0.004	0.992	0.003	0.960	0.000	0.958	0.004	0.991	0.003	0.918	0.004	Download

Download datasets

Positive dataset

Negative dataset