Basic Information
ID: ALA3734252
Type: Binding
Description: Binding affinity to pyruvate dehydrogenase kinase 1 (unknown origin) incubated for 90 mins by VER-00160364 probe based fluorescence polarization assay
Organism: Homo sapiens
Activity Charts
Bioactivity
Activity Types for Assay ALA3734252
IC50
Compound Summary
| Parent Molecular Weight | ALogP | Polar Surface Area |
|---|---|---|
| 523.61 | 5.83 | 5.83 |
| 523.61 | 5.83 | 5.83 |
| 478.60 | 5.34 | 5.34 |
| 525.63 | 5.77 | 5.77 |
| 523.61 | 5.83 | 5.83 |
| 523.61 | 5.83 | 5.83 |
| 523.61 | 5.83 | 5.83 |
| 556.56 | 6.18 | 6.18 |
| 524.60 | 5.22 | 5.22 |
| 502.59 | 5.29 | 5.29 |
| 396.47 | 3.71 | 3.71 |
| 522.63 | 6.43 | 6.43 |
| 522.63 | 6.43 | 6.43 |
| 537.04 | 5.94 | 5.94 |
| 410.50 | 4.02 | 4.02 |
| 538.63 | 5.53 | 5.53 |
| 516.62 | 5.60 | 5.60 |
| 585.71 | 5.86 | 5.86 |
| 563.70 | 5.55 | 5.55 |
| 566.71 | 4.22 | 4.22 |
| 578.72 | 4.31 | 4.31 |
| 565.67 | 4.40 | 4.40 |
| 553.66 | 3.99 | 3.99 |
| 606.73 | 4.23 | 4.23 |
| 599.68 | 5.80 | 5.80 |
| 571.63 | 5.02 | 5.02 |
| 586.70 | 5.25 | 5.25 |
| 451.94 | 5.43 | 5.43 |
| 446.53 | 4.90 | 4.90 |
| 467.55 | 5.92 | 5.92 |
| 487.61 | 6.29 | 6.29 |
| 452.54 | 6.22 | 6.22 |
| 453.52 | 5.62 | 5.62 |
| 470.47 | 6.09 | 6.09 |
| 459.55 | 5.68 | 5.68 |
| 493.97 | 5.19 | 5.19 |
| 462.53 | 5.09 | 5.09 |
| 433.49 | 4.47 | 4.47 |
| 538.47 | 7.11 | 7.11 |
| 499.51 | 6.10 | 6.10 |
| 418.48 | 4.05 | 4.05 |
| 461.93 | 5.59 | 5.59 |
| 482.56 | 5.71 | 5.71 |
| 467.93 | 5.13 | 5.13 |
| 480.59 | 6.78 | 6.78 |
| 496.59 | 6.54 | 6.54 |
| 432.50 | 4.56 | 4.56 |
| 484.55 | 6.67 | 6.67 |
| 476.95 | 5.60 | 5.60 |
| 510.62 | 6.93 | 6.93 |
| 488.59 | 5.67 | 5.67 |
| 473.58 | 5.99 | 5.99 |
| 501.01 | 7.18 | 7.18 |
| 521.52 | 6.64 | 6.64 |
| 517.01 | 6.88 | 6.88 |
| 466.56 | 6.53 | 6.53 |
| 484.55 | 6.67 | 6.67 |
| 511.56 | 5.40 | 5.40 |
| 431.52 | 5.08 | 5.08 |
| 486.38 | 6.08 | 6.08 |
| 471.51 | 5.76 | 5.76 |
| 417.49 | 4.77 | 4.77 |
| 431.52 | 5.03 | 5.03 |
| 487.97 | 6.27 | 6.27 |
| 495.58 | 4.02 | 4.02 |
| 461.52 | 5.86 | 5.86 |
| 445.91 | 5.36 | 5.36 |
| 411.46 | 4.71 | 4.71 |
| 412.45 | 4.11 | 4.11 |
| 431.52 | 5.08 | 5.08 |
| 446.89 | 4.76 | 4.76 |
| 488.93 | 4.52 | 4.52 |
| 494.47 | 5.43 | 5.43 |
| 471.90 | 4.93 | 4.93 |
| 469.55 | 4.48 | 4.48 |
| 481.34 | 5.41 | 5.41 |
| 533.43 | 6.44 | 6.44 |
| 468.54 | 5.32 | 5.32 |
| 437.46 | 5.15 | 5.15 |
| 440.50 | 4.67 | 4.67 |
| 413.44 | 3.38 | 3.38 |
| 428.45 | 3.81 | 3.81 |
| 478.96 | 5.17 | 5.17 |
| 453.52 | 5.62 | 5.62 |
| 456.89 | 4.93 | 4.93 |
| 457.49 | 4.42 | 4.42 |
| 446.89 | 4.76 | 4.76 |
| 446.89 | 4.76 | 4.76 |
| 498.54 | 4.59 | 4.59 |
| 437.46 | 5.15 | 5.15 |
| 440.50 | 4.75 | 4.75 |
| 462.89 | 4.46 | 4.46 |
| 441.49 | 4.23 | 4.23 |
| 412.45 | 4.11 | 4.11 |
| 448.48 | 4.95 | 4.95 |
| 427.46 | 3.84 | 3.84 |
| 484.58 | 5.01 | 5.01 |
| 462.51 | 5.26 | 5.26 |
| 465.43 | 5.42 | 5.42 |
| 475.55 | 6.12 | 6.12 |
| 479.51 | 6.00 | 6.00 |
| 479.51 | 6.00 | 6.00 |
| 475.55 | 6.17 | 6.17 |
| 423.43 | 3.67 | 3.67 |
| 483.55 | 5.00 | 5.00 |
| 445.91 | 5.36 | 5.36 |
| 427.46 | 3.89 | 3.89 |
| 491.55 | 5.87 | 5.87 |
| 477.52 | 5.05 | 5.05 |
| 495.97 | 6.52 | 6.52 |
| 505.57 | 6.26 | 6.26 |
| 495.97 | 6.52 | 6.52 |
| 426.48 | 4.36 | 4.36 |
| 426.48 | 4.41 | 4.41 |
| 431.88 | 5.06 | 5.06 |
| 412.45 | 4.11 | 4.11 |
| 467.53 | 5.27 | 5.27 |
| 520.55 | 5.13 | 5.13 |
| 516.48 | 5.97 | 5.97 |
| 450.50 | 5.19 | 5.19 |
| 491.51 | 4.05 | 4.05 |
| 508.53 | 4.97 | 4.97 |
| 524.58 | 6.62 | 6.62 |
| 511.97 | 5.70 | 5.70 |
| 471.90 | 5.80 | 5.80 |
| 466.47 | 5.09 | 5.09 |
| 482.93 | 5.60 | 5.60 |
| 530.61 | 6.68 | 6.68 |
| 413.44 | 3.38 | 3.38 |
| 464.49 | 3.98 | 3.98 |
| 453.50 | 4.37 | 4.37 |
| 448.48 | 4.95 | 4.95 |
| 437.46 | 4.28 | 4.28 |
| 516.48 | 5.97 | 5.97 |
| 477.52 | 4.99 | 4.99 |
| 478.51 | 4.29 | 4.29 |
| 467.53 | 4.40 | 4.40 |
| 478.51 | 4.29 | 4.29 |
| 483.53 | 3.63 | 3.63 |
| 460.92 | 5.67 | 5.67 |
| 444.92 | 5.97 | 5.97 |
| 465.34 | 6.31 | 6.31 |
| 430.89 | 5.66 | 5.66 |
| 421.46 | 4.88 | 4.88 |
| 426.47 | 5.02 | 5.02 |
| 456.50 | 5.02 | 5.02 |
| 426.48 | 4.41 | 4.41 |
| 425.49 | 5.02 | 5.02 |
| 586.70 | 5.25 | 5.25 |
| 504.57 | 3.62 | 3.62 |
| 580.67 | 5.19 | 5.19 |
| 560.63 | 3.73 | 3.73 |
| 573.67 | 3.65 | 3.65 |
| 562.65 | 3.98 | 3.98 |
| 561.66 | 3.55 | 3.55 |
| 558.66 | 4.88 | 4.88 |
| 575.65 | 3.12 | 3.12 |
| 566.59 | 4.35 | 4.35 |
| 581.65 | 4.58 | 4.58 |
| 575.65 | 3.25 | 3.25 |
| 601.68 | 3.56 | 3.56 |
| 581.65 | 4.58 | 4.58 |
| 594.64 | 5.13 | 5.13 |
| 581.65 | 4.58 | 4.58 |
| 532.00 | 5.27 | 5.27 |
| 487.94 | 4.92 | 4.92 |
| 425.87 | 3.70 | 3.70 |
| 391.43 | 3.04 | 3.04 |
| 518.57 | 5.16 | 5.16 |
| 497.55 | 4.62 | 4.62 |
| 483.52 | 4.28 | 4.28 |
| 518.57 | 5.16 | 5.16 |
| 377.40 | 2.70 | 2.70 |
| 403.44 | 3.23 | 3.23 |
| 473.55 | 4.67 | 4.67 |
| 519.56 | 4.56 | 4.56 |
| 448.52 | 2.97 | 2.97 |
| 492.54 | 4.48 | 4.48 |
| 518.57 | 5.16 | 5.16 |
| 518.57 | 5.16 | 5.16 |
| 518.57 | 5.16 | 5.16 |
| 518.57 | 5.16 | 5.16 |
| 447.49 | 2.94 | 2.94 |
| 551.52 | 5.51 | 5.51 |
| 517.59 | 5.77 | 5.77 |
| 517.59 | 5.77 | 5.77 |
| 560.68 | 4.16 | 4.16 |
| 503.58 | 4.22 | 4.22 |
| 579.68 | 5.79 | 5.79 |
| 585.71 | 5.86 | 5.86 |
| 557.67 | 5.49 | 5.49 |
| 559.64 | 4.34 | 4.34 |
| 572.69 | 4.25 | 4.25 |
| 561.66 | 4.58 | 4.58 |
| 574.66 | 3.73 | 3.73 |
| 600.70 | 4.17 | 4.17 |
| 580.67 | 5.19 | 5.19 |
| 574.66 | 3.86 | 3.86 |
| 565.60 | 4.95 | 4.95 |
| 580.67 | 5.19 | 5.19 |
| 593.65 | 5.74 | 5.74 |
| 615.11 | 5.84 | 5.84 |
| 449.89 | 4.17 | 4.17 |
| 517.59 | 5.77 | 5.77 |
| 424.88 | 4.30 | 4.30 |
| 438.91 | 4.61 | 4.61 |
| 440.88 | 4.01 | 4.01 |
| 531.01 | 5.88 | 5.88 |
| 390.44 | 3.65 | 3.65 |
| 404.47 | 4.21 | 4.21 |
| 438.91 | 4.86 | 4.86 |
| 545.04 | 6.19 | 6.19 |
| 442.87 | 4.44 | 4.44 |
| 492.88 | 5.32 | 5.32 |
| 438.91 | 4.86 | 4.86 |
| 438.91 | 4.86 | 4.86 |
| 496.56 | 5.23 | 5.23 |
| 534.53 | 6.24 | 6.24 |
| 482.54 | 4.88 | 4.88 |
| 518.57 | 5.16 | 5.16 |
| 402.45 | 3.84 | 3.84 |
| 376.41 | 3.30 | 3.30 |
| 517.59 | 5.77 | 5.77 |
| 472.57 | 5.28 | 5.28 |
| 517.59 | 5.77 | 5.77 |
| 447.54 | 3.58 | 3.58 |
| 446.50 | 3.54 | 3.54 |
| 517.59 | 5.77 | 5.77 |
| 517.59 | 5.77 | 5.77 |
| 517.59 | 5.77 | 5.77 |
| 516.60 | 6.37 | 6.37 |
| 516.60 | 6.37 | 6.37 |
| 445.91 | 5.36 | 5.36 |
| 319.36 | 3.94 | 3.94 |
| 444.92 | 5.97 | 5.97 |
| 410.47 | 5.32 | 5.32 |
| 411.46 | 4.71 | 4.71 |
| 399.45 | 4.35 | 4.35 |
| 487.94 | 5.13 | 5.13 |
| 439.52 | 5.27 | 5.27 |
| 470.92 | 5.54 | 5.54 |
| 493.49 | 6.04 | 6.04 |
| 425.49 | 4.90 | 4.90 |
| 425.49 | 4.90 | 4.90 |
| 453.52 | 5.62 | 5.62 |
| 461.91 | 5.06 | 5.06 |
| 445.91 | 5.36 | 5.36 |
| 445.91 | 5.36 | 5.36 |
| 439.52 | 5.35 | 5.35 |
| 487.97 | 6.27 | 6.27 |
| 478.50 | 5.06 | 5.06 |
| 497.55 | 5.20 | 5.20 |
| 426.48 | 4.44 | 4.44 |
| 468.56 | 5.53 | 5.53 |
| 461.52 | 5.86 | 5.86 |
| 480.35 | 6.02 | 6.02 |
| 411.46 | 4.71 | 4.71 |
| 465.51 | 5.09 | 5.09 |
| 447.49 | 5.56 | 5.56 |
| 422.44 | 4.27 | 4.27 |
| 482.57 | 5.61 | 5.61 |
| 459.93 | 5.92 | 5.92 |
| 470.92 | 5.24 | 5.24 |
| 425.49 | 4.96 | 4.96 |
| 425.49 | 5.02 | 5.02 |
| 411.46 | 4.71 | 4.71 |
| 449.51 | 5.80 | 5.80 |
| 476.53 | 5.65 | 5.65 |
| 490.56 | 6.48 | 6.48 |
| 426.47 | 4.50 | 4.50 |
| 491.50 | 5.25 | 5.25 |
| 490.52 | 4.65 | 4.65 |
| 519.56 | 5.73 | 5.73 |
| 523.59 | 7.22 | 7.22 |
| 459.93 | 5.92 | 5.92 |
| 529.62 | 7.28 | 7.28 |
| 465.48 | 5.69 | 5.69 |
| 510.98 | 6.31 | 6.31 |
| 481.94 | 6.21 | 6.21 |
| 425.49 | 4.90 | 4.90 |
| 436.47 | 4.58 | 4.58 |
| 452.51 | 4.98 | 4.98 |
| 487.56 | 6.38 | 6.38 |
| 505.55 | 6.52 | 6.52 |
| 412.45 | 3.98 | 3.98 |
| 435.48 | 4.69 | 4.69 |
| 463.50 | 4.59 | 4.59 |
| 459.93 | 5.67 | 5.67 |
| 515.49 | 6.57 | 6.57 |
| 447.49 | 5.56 | 5.56 |
| 492.55 | 6.92 | 6.92 |
| 488.55 | 5.77 | 5.77 |
| 463.90 | 5.50 | 5.50 |
| 429.45 | 4.85 | 4.85 |
| 496.51 | 6.75 | 6.75 |
| 475.55 | 6.17 | 6.17 |
| 475.93 | 5.37 | 5.37 |
| 466.54 | 5.00 | 5.00 |
| 477.52 | 4.90 | 4.90 |
| 482.54 | 4.24 | 4.24 |
| 429.90 | 6.27 | 6.27 |
| 477.52 | 4.90 | 4.90 |
| 425.49 | 5.02 | 5.02 |
| 424.50 | 5.62 | 5.62 |
| 536.63 | 8.14 | 8.14 |
| 439.52 | 5.33 | 5.33 |
| 480.35 | 6.02 | 6.02 |
| 496.35 | 5.72 | 5.72 |
| 459.93 | 5.67 | 5.67 |
| 494.98 | 7.12 | 7.12 |
| 454.53 | 4.78 | 4.78 |
| 560.44 | 6.26 | 6.26 |
| 459.93 | 5.67 | 5.67 |
| 475.93 | 5.37 | 5.37 |
| 513.90 | 6.38 | 6.38 |
| 443.93 | 6.57 | 6.57 |
| 470.92 | 5.31 | 5.31 |
| 504.01 | 5.84 | 5.84 |
| 496.51 | 6.75 | 6.75 |
| 510.59 | 7.62 | 7.62 |
| 506.63 | 7.19 | 7.19 |
| 494.98 | 7.12 | 7.12 |
| 496.51 | 6.75 | 6.75 |
| 542.60 | 6.83 | 6.83 |
| 478.52 | 6.61 | 6.61 |
| 478.52 | 6.61 | 6.61 |
| 474.56 | 6.78 | 6.78 |
| 543.67 | 7.06 | 7.06 |
| 529.04 | 5.96 | 5.96 |
| 517.63 | 6.53 | 6.53 |
| 559.67 | 6.30 | 6.30 |
| 517.63 | 6.58 | 6.58 |
| 405.45 | 4.09 | 4.09 |
| 445.52 | 5.01 | 5.01 |
| 454.49 | 4.98 | 4.98 |
| 467.53 | 5.27 | 5.27 |
| 460.53 | 3.82 | 3.82 |
| 438.48 | 5.20 | 5.20 |
| 376.41 | 3.90 | 3.90 |
| 452.51 | 5.13 | 5.13 |
| 494.57 | 6.41 | 6.41 |
| 477.52 | 5.68 | 5.68 |
| 443.46 | 4.49 | 4.49 |
| 412.47 | 3.32 | 3.32 |
| 431.92 | 3.10 | 3.10 |
| 445.95 | 3.59 | 3.59 |
| 428.88 | 3.03 | 3.03 |
| 425.87 | 3.70 | 3.70 |
| 416.91 | 4.29 | 4.29 |
| 425.87 | 3.70 | 3.70 |
| 414.85 | 3.02 | 3.02 |
| 464.91 | 4.18 | 4.18 |
| 515.42 | 6.17 | 6.17 |
| 535.98 | 5.18 | 5.18 |
| 382.46 | 3.64 | 3.64 |
| 394.43 | 2.38 | 2.38 |
| 444.49 | 3.53 | 3.53 |