Esterase with broad substrate specificity. Contributes to the inactivation of the neurotransmitter acetylcholine. Can degrade neurotoxic organophosphate esters.
| Uniprot primary ID | P06276 |
| PDB ID | 1XLU 3DJY 2WIJ 2WIK 1XLW 1XLV 2WIL 2Y1K 2WIF 2WIG 2WID 2PM8 2J4C 4B0P 4AXB 1KCJ 2XQG 2XQF 4B0O 2WSL 2XQI 2XQK 2XQJ 1EHQ 4BDS 4AQD 1EHO 4BBZ 4TPK 3DKK 1P0M 1P0I 2XMC 2XMB 2XMD 2XMG 3O9M 1P0Q 1P0P |
| DrugBank ID | DB01161 DB00979 DB00772 DB00082 DB00892 DB00677 DB00674 DB00202 DB04920 DB00449 DB01057 DB00856 DB00527 DB00733 DB01338 DB00620 DB01400 DB01135 DB00545 DB01337 DB01408 DB01010 DB00941 DB00944 DB00762 DB00721 DB01395 DB00122 DB00585 DB01116 DB00358 DB00989 |
| BioGrid ID | 107064 |
| GuidetoPHARMACOLOGY ID | 2471 |
| PharmGKB ID | PA25294 |
| KEGG ID | hsa:590 |
| BioCyc | |
| Entrez Gene (Gene ID) | 590 |
| DIP | DIP-46476N |
| STRING | 9606ENSP00000264381 |
| MINT | |
| IntAct | |
| DMDM | 116353 |
| BREDNA | 3118 |
| Rectome | R-HSA-112311 R-HSA-1483191 R-HSA-422085 |
| SignaLink | |
| BindingDB | P06276 |
| 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 | 0.698 | 0.788 | 0.725 | 0.633 | 0.817 | 0.728 | 0.819 | 0.741 | 0.683 | 0.802 | Download |
| MACCS fingerprints | 0.732 | 0.781 | 0.712 | 0.784 | 0.641 | 0.759 | 0.828 | 0.746 | 0.816 | 0.680 | Download |
| Daylight fingerprints | 0.634 | 0.652 | 0.641 | 0.620 | 0.661 | 0.637 | 0.662 | 0.641 | 0.622 | 0.660 | Download |
| ECFP2 fingerprints | 0.797 | 0.879 | 0.800 | 0.786 | 0.813 | 0.841 | 0.910 | 0.838 | 0.842 | 0.834 | Download |
| ECFP4 fingerprints | 0.797 | 0.886 | 0.812 | 0.734 | 0.890 | 0.838 | 0.909 | 0.845 | 0.787 | 0.905 | Download |
| ECFP6 fingerprints | 0.756 | 0.874 | 0.787 | 0.656 | 0.919 | 0.817 | 0.901 | 0.833 | 0.734 | 0.936 | Download |
| Positive dataset | Negative dataset |
Copyright @ 2012-2014 Computational Biology & Drug Design Group,
School of Pharmaceutical Sciences, Central South University.
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