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Assay Detail

CHEMBL1908679

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Binding
Binding constant for ABL1(F317L)-phosphorylated kinase domain
72
Total Activities
72
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Autocuration

Target

Tyrosine-protein kinase ABL1 (CHEMBL1862)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Comprehensive analysis of kinase inhibitor selectivity.
Davis MI, Hunt JP, Herrgard S, Ciceri P, Wodicka LM, Pallares G, Hocker M, Treiber DK, Zarrinkar PP.
Nat Biotechnol (2011) 29 : 1046 -1051
PubMed 22037378 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 72 6.60 10.72

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5416410 DASATINIB 4.0 1 10.72
CHEMBL288441 BOSUTINIB 4.0 1 10.54
CHEMBL386051 1 8.60
CHEMBL574738 AST-487 1.0 1 7.89
CHEMBL255863 NILOTINIB 4.0 1 7.85
CHEMBL509032 TAE-684 1 7.72
CHEMBL24828 VANDETANIB 4.0 1 7.48
CHEMBL388978 STAUROSPORINE 1 7.34
CHEMBL31965 CANERTINIB 3.0 1 7.04
CHEMBL1908397 KW-2449 1.0 1 7.03
CHEMBL941 IMATINIB 4.0 1 6.96
CHEMBL1908391 MASITINIB 3.0 1 6.96
CHEMBL553 ERLOTINIB 4.0 1 6.82
CHEMBL1230609 FORETINIB 2.0 1 6.77
CHEMBL1287853 FEDRATINIB 4.0 1 6.75
CHEMBL1173655 AFATINIB 4.0 1 6.64
CHEMBL1241674 1 6.62
CHEMBL491473 CEDIRANIB 3.0 1 6.55
CHEMBL1289926 AXITINIB 4.0 1 6.48
CHEMBL535 SUNITINIB 4.0 1 6.43
CHEMBL572878 TOZASERTIB 2.0 1 6.40
CHEMBL601719 CRIZOTINIB 4.0 1 6.23
CHEMBL502835 NINTEDANIB 4.0 1 6.19
CHEMBL939 GEFITINIB 4.0 1 6.11
CHEMBL428690 ALVOCIDIB 3.0 1 6.05
CHEMBL1908396 1 6.00
CHEMBL522892 DOVITINIB 3.0 1 5.96
CHEMBL1721885 SU-014813 2.0 1 5.92
CHEMBL1908395 1 5.92
CHEMBL603469 LESTAURTINIB 3.0 1 5.66

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5416410 DASATINIB Kd = 0.019 nM 10.72
CHEMBL288441 BOSUTINIB Kd = 0.029 nM 10.54
CHEMBL386051 Kd = 2.5 nM 8.60
CHEMBL574738 AST-487 Kd = 13.0 nM 7.89
CHEMBL255863 NILOTINIB Kd = 14.0 nM 7.85
CHEMBL509032 TAE-684 Kd = 19.0 nM 7.72
CHEMBL24828 VANDETANIB Kd = 33.0 nM 7.48
CHEMBL388978 STAUROSPORINE Kd = 46.0 nM 7.34
CHEMBL31965 CANERTINIB Kd = 91.0 nM 7.04
CHEMBL1908397 KW-2449 Kd = 94.0 nM 7.03
CHEMBL941 IMATINIB Kd = 110.0 nM 6.96
CHEMBL1908391 MASITINIB Kd = 110.0 nM 6.96
CHEMBL553 ERLOTINIB Kd = 150.0 nM 6.82
CHEMBL1230609 FORETINIB Kd = 170.0 nM 6.77
CHEMBL1287853 FEDRATINIB Kd = 180.0 nM 6.75
CHEMBL1173655 AFATINIB Kd = 230.0 nM 6.64
CHEMBL1241674 Kd = 240.0 nM 6.62
CHEMBL491473 CEDIRANIB Kd = 280.0 nM 6.55
CHEMBL1289926 AXITINIB Kd = 330.0 nM 6.48
CHEMBL535 SUNITINIB Kd = 370.0 nM 6.43
CHEMBL572878 TOZASERTIB Kd = 400.0 nM 6.40
CHEMBL601719 CRIZOTINIB Kd = 590.0 nM 6.23
CHEMBL502835 NINTEDANIB Kd = 640.0 nM 6.19
CHEMBL939 GEFITINIB Kd = 780.0 nM 6.11
CHEMBL428690 ALVOCIDIB Kd = 890.0 nM 6.05
CHEMBL1908396 Kd = 1000.0 nM 6.00
CHEMBL522892 DOVITINIB Kd = 1100.0 nM 5.96
CHEMBL1721885 SU-014813 Kd = 1200.0 nM 5.92
CHEMBL1908395 Kd = 1200.0 nM 5.92
CHEMBL603469 LESTAURTINIB Kd = 2200.0 nM 5.66
CHEMBL1789941 RUXOLITINIB Kd = 2200.0 nM 5.66
CHEMBL377300 BRIVANIB Kd = 2300.0 nM 5.64
CHEMBL215152 DEFOSBARASERTIB Kd = 2300.0 nM 5.64
CHEMBL513909 BI-2536 Kd = 2400.0 nM 5.62
CHEMBL477772 PAZOPANIB Kd = 2700.0 nM 5.57
CHEMBL450786 PHA-665752 Kd = 2900.0 nM 5.54
CHEMBL1230020 PLX-4720 Kd = 5700.0 nM 5.24
CHEMBL1336 SORAFENIB Kd = 7100.0 nM 5.15
CHEMBL572881 MOTESANIB Kd = 7700.0 nM 5.11
CHEMBL230011 TG100-115 Kd = 8400.0 nM 5.08
CHEMBL494089 GSK-690693 Kd > 10000.0 nM -
CHEMBL1236107 SGX-523 Kd > 10000.0 nM -
CHEMBL379218 Kd > 10000.0 nM -
CHEMBL1908394 GSK-461364 Kd > 10000.0 nM -
CHEMBL259084 MLN-8054 Kd > 10000.0 nM -
CHEMBL1614701 SELUMETINIB Kd > 10000.0 nM -
CHEMBL558752 RAF-265 Kd > 10000.0 nM -
CHEMBL464552 Kd > 10000.0 nM -
CHEMBL608533 MIDOSTAURIN Kd > 10000.0 nM -
CHEMBL445813 AT-7519 Kd > 10000.0 nM -