Dasatinib Anhydrous

Dasatinib Anhydrous

SCHEMBL28446951

CS(=O)(=O)O.Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCN(CCO)CC2)n1.O

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1BCRBLKEPHA2FGRFRKFYNHCKKITLCKLYNPDGFRBSRCSRMSYES1

The experimentally established mechanism targets of Dasatinib Anhydrous. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 known ✓ P00519 10/20 0.94
SRC known ✓ P12931 6/20 0.94
LCK known ✓ P06239 4/20 0.94
FYN known ✓ P06241 2/20 0.94
YES1 known ✓ P07947 2/20 0.94
LYN known ✓ P07948 2/20 0.94
HCK known ✓ P08631 2/20 0.94
KIT known ✓ P10721 2/20 0.94
BCR known ✓ P11274 2/20 0.94
EPHA2 known ✓ P29317 2/20 0.94
FRK known ✓ P42685 2/20 0.94
PDGFRB known ✓ P09619 1/20 0.94
FGR known ✓ P09769 1/20 0.94
BLK known ✓ P51451 1/20 0.94
SRMS known ✓ Q9H3Y6 1/20 0.94
SIK2 Q9H0K1 7/20 0.94
SIK3 Q9Y2K2 7/20 0.94
SIK1 P57059 5/20 0.94
PKMYT1 Q99640 3/20 0.94
EPHB6 O15197 2/20 0.94

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Dasatinib Anhydrous SCHEMBL28151013 0.99 ABL1 (0.94) ABL1SIK2SIK3SRCSIK1
Dasatinib Anhydrous SCHEMBL15012468 0.98 ABL1 (0.94) ABL1SIK2SIK3SRCSIK1
Dasatinib Anhydrous SCHEMBL29377489 0.97 ABL1 (1.00) ABL1SIK2SIK3SRCSIK1
Dasatinib Anhydrous SCHEMBL290515 0.97 ABL1 (1.00) ABL1SIK2SIK3SRCSIK1
Dasatinib Anhydrous SCHEMBL16618598 0.97 ABL1 (1.00) ABL1SIK2SIK3SRCSIK1
Dasatinib Anhydrous SCHEMBL29482416 0.97 ABL1 (1.00) ABL1SIK2SIK3SRCSIK1
Dasatinib Anhydrous SCHEMBL16618224 0.97 ABL1 (1.00) ABL1SIK2SIK3SRCSIK1
Dasatinib Anhydrous SCHEMBL16913911 0.96 ABL1 (0.98) ABL1SIK2SIK3SRCSIK1
Dasatinib Anhydrous SCHEMBL29381185 0.96 ABL1 (1.00) ABL1SIK2SIK3SRCSIK1
Dasatinib Anhydrous SCHEMBL28350326 0.96 ABL1 (1.00) ABL1SIK2SIK3SRCSIK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111629734-A Novel platform for co-stimulation, novel CAR design and other enhancements of adoptive cell therapy 南加利福尼亚大学 2020-09-04 CN disclosed