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Table 2 Comprehensive Performance Metrics of pdCSM-GPCR and AiGPro Models for 36 GPCRs supported by pdCSM-GPCR, including Pearson and Spearman and Mean Squared Error (MSE)

From: AiGPro: a multi-tasks model for profiling of GPCRs for agonist and antagonist

Metric

Pearson

MSE

Spearman

UniProt ID

AiGPro Agonist

AiGPro Antagonist

pdCSM-GPCR

AiGPro Agonist

AiGPro Antagonist

pdCSM-GPCR

AiGPro Agonist

AiGPro Antagonist

pdCSM-GPCR

P08173

0.677697

0.844019

0.927161

0.598459

0.262448

0.138784

0.681418

0.811225

0.920255

P08908

0.689659

0.921445

0.913819

1.440755

0.197048

0.244769

0.725641

0.930697

0.915411

P08912

0.558878

0.73516

0.96047

0.389232

0.23069

0.039637

0.643617

0.795608

0.931363

P0DMS8

0.724056

0.898625

0.837471

1.079031

0.309748

0.416983

0.71744

0.902301

0.929995

P20309

0.756877

0.857717

-0.18575

2.387652

0.741582

16.83852

0.752055

0.830525

0.239374

P21452

0.903191

0.977033

0.661544

0.632052

0.106288

1.393349

0.890782

0.970373

0.868128

P21917

0.763711

0.890759

0.894257

0.439251

0.198539

0.219516

0.792558

0.883109

0.891361

P24530

0.790824

0.858437

0.926488

0.5765

0.340872

0.28856

0.845828

0.925262

0.923018

P28335

0.783483

0.925001

0.936922

0.525033

0.148203

0.165385

0.778624

0.92579

0.937908

P29275

0.57747

0.747991

0.89956

1.744522

0.576609

0.22598

0.604479

0.782773

0.894269

P30542

0.63934

0.90017

0.396229

1.493945

0.250213

1.440032

0.551049

0.930075

0.876307

P30968

0.577188

0.492209

0.339559

2.246996

2.080604

2.551277

0.469937

0.363065

0.799985

P34995

0.780087

0.860241

0.577697

0.64427

0.328886

0.924773

0.83424

0.911129

0.534206

P35346

0.44117

0.479922

0.65292

1.939671

2.200727

0.843807

0.333241

0.423323

0.650743

P35348

0.899096

0.962053

– 0.15992

0.390727

0.120603

8.235974

0.911268

0.96074

0.526311

P35372

0.732431

0.846547

0.381958

1.671303

0.620345

3.148592

0.722602

0.837374

0.802032

P41180

0.814046

0.948219

0.84282

0.595652

0.096359

0.245888

0.797648

0.939531

0.814971

P46663

0.882107

0.935077

0.752952

0.704371

0.301326

1.084366

0.872538

0.936141

0.833231

P47871

0.7521

0.883138

0.851745

0.994021

0.253084

0.471346

0.688865

0.809073

0.800408

P47900

0.632413

0.757002

0.93903

1.304861

0.439505

0.149359

0.675703

0.900808

0.900456

P48039

0.78483

0.933192

− 0.32359

1.172908

0.235479

9.592626

0.794298

0.935882

0.406757

P50406

0.813097

0.923785

0.941495

0.735113

0.222674

0.202607

0.84594

0.943349

0.940951

P51677

0.916871

0.969147

0.524032

0.319415

0.089995

1.309028

0.929045

0.976074

0.879858

Q14416

0.904959

0.944118

0.939619

0.210774

0.096948

0.086333

0.905397

0.941748

0.89801

Q14833

0.390707

0.312899

− 0.54542

2.303484

2.421646

6.00078

0.805074

0.715054

0.660051

Q16602

0.451143

0.536767

− 0.06658

2.691533

2.156264

9.260116

0.425713

0.525492

0.481879

Q8TDS4

0.858214

0.907132

0.771218

0.319798

0.149885

0.350926

0.866247

0.903202

0.754774

Q8TDU6

0.981837

0.874889

0.880415

0.072351

0.563678

0.419429

0.979498

0.872989

0.87819

Q96LB2

0.807737

0.880264

0.819568

0.252343

0.210351

0.233144

0.873239

0.890536

0.745612

Q99500

0.896725

0.911844

0.531145

0.174193

0.129037

0.602572

0.91287

0.928918

0.467122

Q99705

0.826176

0.944241

0.883057

0.606932

0.097271

0.224144

0.827514

0.941554

0.887913

Q99835

0.70499

0.990305

0.889806

0.880702

0.015348

0.164317

0.73248

0.987365

0.917692

Q9H228

0.82701

0.838706

0.737199

0.415411

0.738059

0.620671

0.713968

0.765747

0.82804

Q9HC97

0.851701

0.778585

0.911147

0.413254

0.862635

0.28222

0.766518

0.665466

0.917893

Q9Y5N1

0.866684

0.95228

0.873469

0.376423

0.142348

0.340459

0.868995

0.942514

0.852287

Q9Y5Y4

0.8684

0.969928

0.734544

0.564619

0.088746

0.606321

0.869558

0.974374

0.748595