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Assay Detail

CHEMBL1908680

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Binding
Binding constant for ABL1(H396P)-non 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 6.96 10.60

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5416410 DASATINIB 4.0 1 10.60
CHEMBL288441 BOSUTINIB 4.0 1 10.21
CHEMBL386051 1 9.20
CHEMBL574738 AST-487 1.0 1 8.59
CHEMBL572878 TOZASERTIB 2.0 1 8.48
CHEMBL255863 NILOTINIB 4.0 1 8.31
CHEMBL941 IMATINIB 4.0 1 8.23
CHEMBL24828 VANDETANIB 4.0 1 8.01
CHEMBL1230609 FORETINIB 2.0 1 8.00
CHEMBL1908391 MASITINIB 3.0 1 7.96
CHEMBL1908397 KW-2449 1.0 1 7.77
CHEMBL388978 STAUROSPORINE 1 7.75
CHEMBL1289926 AXITINIB 4.0 1 7.70
CHEMBL601719 CRIZOTINIB 4.0 1 7.48
CHEMBL491473 CEDIRANIB 3.0 1 7.41
CHEMBL522892 DOVITINIB 3.0 1 7.38
CHEMBL502835 NINTEDANIB 4.0 1 7.35
CHEMBL1287853 FEDRATINIB 4.0 1 7.35
CHEMBL31965 CANERTINIB 3.0 1 7.34
CHEMBL1241674 1 7.31
CHEMBL509032 TAE-684 1 7.14
CHEMBL535 SUNITINIB 4.0 1 7.13
CHEMBL553 ERLOTINIB 4.0 1 7.05
CHEMBL1908396 1 6.85
CHEMBL475251 R-406 2.0 1 6.77
CHEMBL1721885 SU-014813 2.0 1 6.62
CHEMBL1908395 1 6.55
CHEMBL477772 PAZOPANIB 4.0 1 6.42
CHEMBL377300 BRIVANIB 3.0 1 6.41
CHEMBL1173655 AFATINIB 4.0 1 6.30

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5416410 DASATINIB Kd = 0.025 nM 10.60
CHEMBL288441 BOSUTINIB Kd = 0.062 nM 10.21
CHEMBL386051 Kd = 0.63 nM 9.20
CHEMBL574738 AST-487 Kd = 2.6 nM 8.59
CHEMBL572878 TOZASERTIB Kd = 3.3 nM 8.48
CHEMBL255863 NILOTINIB Kd = 4.9 nM 8.31
CHEMBL941 IMATINIB Kd = 5.9 nM 8.23
CHEMBL24828 VANDETANIB Kd = 9.8 nM 8.01
CHEMBL1230609 FORETINIB Kd = 10.0 nM 8.00
CHEMBL1908391 MASITINIB Kd = 11.0 nM 7.96
CHEMBL1908397 KW-2449 Kd = 17.0 nM 7.77
CHEMBL388978 STAUROSPORINE Kd = 18.0 nM 7.75
CHEMBL1289926 AXITINIB Kd = 20.0 nM 7.70
CHEMBL601719 CRIZOTINIB Kd = 33.0 nM 7.48
CHEMBL491473 CEDIRANIB Kd = 39.0 nM 7.41
CHEMBL522892 DOVITINIB Kd = 42.0 nM 7.38
CHEMBL502835 NINTEDANIB Kd = 45.0 nM 7.35
CHEMBL1287853 FEDRATINIB Kd = 45.0 nM 7.35
CHEMBL31965 CANERTINIB Kd = 46.0 nM 7.34
CHEMBL1241674 Kd = 49.0 nM 7.31
CHEMBL509032 TAE-684 Kd = 73.0 nM 7.14
CHEMBL535 SUNITINIB Kd = 74.0 nM 7.13
CHEMBL553 ERLOTINIB Kd = 89.0 nM 7.05
CHEMBL1908396 Kd = 140.0 nM 6.85
CHEMBL475251 R-406 Kd = 170.0 nM 6.77
CHEMBL1721885 SU-014813 Kd = 240.0 nM 6.62
CHEMBL1908395 Kd = 280.0 nM 6.55
CHEMBL477772 PAZOPANIB Kd = 380.0 nM 6.42
CHEMBL377300 BRIVANIB Kd = 390.0 nM 6.41
CHEMBL1173655 AFATINIB Kd = 500.0 nM 6.30
CHEMBL1230020 PLX-4720 Kd = 510.0 nM 6.29
CHEMBL259084 MLN-8054 Kd = 510.0 nM 6.29
CHEMBL1336 SORAFENIB Kd = 520.0 nM 6.28
CHEMBL939 GEFITINIB Kd = 680.0 nM 6.17
CHEMBL558752 RAF-265 Kd = 920.0 nM 6.04
CHEMBL603469 LESTAURTINIB Kd = 1000.0 nM 6.00
CHEMBL1789941 RUXOLITINIB Kd = 1100.0 nM 5.96
CHEMBL215152 DEFOSBARASERTIB Kd = 1200.0 nM 5.92
CHEMBL428690 ALVOCIDIB Kd = 1200.0 nM 5.92
CHEMBL572881 MOTESANIB Kd = 1400.0 nM 5.85
CHEMBL513909 BI-2536 Kd = 2000.0 nM 5.70
CHEMBL10 SB-203580 Kd = 2600.0 nM 5.58
CHEMBL608533 MIDOSTAURIN Kd = 3100.0 nM 5.51
CHEMBL525191 Kd = 3200.0 nM 5.50
CHEMBL103667 DORAMAPIMOD Kd = 3300.0 nM 5.48
CHEMBL1236107 SGX-523 Kd = 3400.0 nM 5.47
CHEMBL221959 TOFACITINIB Kd = 4500.0 nM 5.35
CHEMBL230011 TG100-115 Kd = 5300.0 nM 5.28
CHEMBL450786 PHA-665752 Kd > 10000.0 nM -
CHEMBL573339 PI-103 Kd > 10000.0 nM -