Table 2 Chemical clustering of the tested compounds.

From: Importance of secondary screening with clinical isolates for anti-leishmania drug discovery

Chemical series

No. of compounds

Compounds

Target class associated

LD275/LD282 classification*

7

TCMDC-143090

 

Panactive

TCMDC-143091

 

TCMDC-143094

 

TCMDC-143095

 

TCMDC-143096

Antiviral

TCMDC-142900

Other Enzyme

TCMDC-143586

 

2

TCMDC-143295

 

Panactive

TCMDC-143607

7

TCMDC-143101

Cytochrome

Panactive

TCMDC-142704

TB

TCMDC-143124

 

TCMDC-143133

 

TCMDC-143558

 

TCMDC-143570

 

TCMDC-143584

Other Enzyme

2

TCMDC-143196

 

Panactive

TCMDC-143344

 

2

TCMDC-143347

Cytochrome, Other Enzyme

Panactive

TCMDC-143351

Cytochrome, Other Enzyme

11

TCMDC-143163

 

Panactive

TCMDC-143164

Other Enzyme

TCMDC-143165

 

TCMDC-143166

Other Enzyme

TCMDC-143169

 

TCMDC-143521

Other Enzyme

TCMDC-143522

 

TCMDC-143534

Other Enzyme

TCMDC-143563

Other Enzyme

TCMDC-143571

 

TCMDC-143577

 

6

TCMDC-143211

 

Panactive

TCMDC-143212

 

TCMDC-143213

 

TCMDC-143214

 

TCMDC-143215

 

TCMDC-143216

 

2

TCMDC-143630

kinase

Panactive

TCMDC-143633

 

2

TCMDC-143280

Kinase, Cytochrome, Other Enzyme

275 selective

TCMDC-143281

Kinase

3

TCMDC-143145

Protease

275 selective

TCMDC-143509

Protease, cytochrome

TCMDC-143568

 

6

TCMDC-143170

Other Enzyme

275 selective

TCMDC-143188

 

TCMDC-143218

TB

TCMDC-134026

 

TCMDC-143404

Kinase

TCMDC-143406

Cytochrome

 

TCMDC-143603

Cytochrome

275 selective

 

TCMDC-143239

Kinase, Antiviral, Other Enzyme

282 selective

8

TCMDC-143348

 

Inactive

TCMDC-143349

 

TCMDC-143367

Kinase, Other Enzyme

TCMDC-143098

 

TCMDC-143197

 

TCMDC-143201

 

TCMDC-143202

 

TCMDC-143573

 

4

TCMDC-143077

 

Inactive

TCMDC-143078

 

TCMDC-125826

 

TCMDC-143621

 
  1. *LD275/LD282 classification representing at least 50% of the cluster members.