Table 1 Publicly accessible web-based target prediction tools

www.gdb.unibe.ch

10 different fingerprints

ChEMBL 21

This work

http://www.pharmaexpert.ru/passonline/

Multilevel neighbourhoods of atoms (MNA) descriptors

WDI and ACD

[10]

http://www.dddc.ac.cn/tarfisdock/

Docking

PDTD

[12]

http://sea.bkslab.org

ECfp4

CHEMBL 16, WOMBAT, MDDR and StarLite

[14]

http://59.78.96.61/pharmmapper/

Receptor-based pharmacophore models

TargetBank, DrugBank, BindingDB, PDTD

[17]

https://cpi.bio-x.cn/drar/

Docking

PDB, DrugBank

[18]

www.cbligand.org/TargetHunter

ECfp6, ECfp4 and Openbabel FP2

ChEMBL 11 and PubChem bioassay

[22]

http://lilab.ecust.edu.cn/chemmapper/

Openbabel FP2, MACSS, SHAFT and USR

ChEMBL 14, BindingDB, DrugBank, KEGG and PDB

[23]

http://mips.helmholtz-muenchen.de/proj/hitpick

Circular fingerprint FCFP

STITCH

[24]

http://modlab-cadd.ethz.ch/software/spider/

CATS and MOE physiochemical descriptors

COBRA

[26]

www.swisstargetprediction.ch

Openbabel FP2 and Electroshape descriptors

ChEMBL 16

[28]

http://prediction.charite.de/index.php

ECfp4

ChEMBL, SuperTarget and BindingDB

[29]

www.dddc.ac.cn/tarpred

ECfp4

BindingDB

[33]

http://potentia.cbs.dtu.dk/ChemProt

Sfp

ChEMBL 14, BindingDB, DrugBank, PharmGKB, PubChem bioassay, WOMBAT, IUPHAR, CTD and STITCH

[37]