Anagrelide

Anagrelide

SCHEMBL1664162

C[S+](C)[O-].O=C1CN2Cc3c(ccc(Cl)c3Cl)N=C2N1

nearest known ligand 0.85

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PDE3APDE3B

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

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE3B known ✓ Q13370 20/20 0.85
PDE3A known ✓ Q14432 20/20 0.85
P2RY12 Q9H244 2/20 0.85
MEN1 O00255 1/20 0.85
PDE2A O00408 1/20 0.85
KMT2A Q03164 1/20 0.85
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
TSHR P16473 1/20 0.37
BLM P54132 1/20 0.37

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
Anagrelide SCHEMBL9411 0.92 PDE3B (1.00) PDE3BPDE3AP2RY12MEN1PDE2A
Anagrelide SCHEMBL29491059 0.92 PDE3B (1.00) PDE3BPDE3AP2RY12MEN1PDE2A
Anagrelide SCHEMBL5060881 0.92 PDE3B (1.00) PDE3BPDE3AP2RY12MEN1PDE2A
Anagrelide SCHEMBL318593 0.91 PDE3B (0.97) PDE3BPDE3AP2RY12MEN1PDE2A
Anagrelide SCHEMBL1449704 0.91 PDE3B (0.97) PDE3BPDE3AP2RY12MEN1PDE2A
Anagrelide SCHEMBL9046734 0.91 PDE3B (0.97) PDE3BPDE3AP2RY12MEN1PDE2A
Anagrelide SCHEMBL1568712 0.91 PDE3B (0.97) PDE3BPDE3AP2RY12MEN1PDE2A
Anagrelide SCHEMBL729172 0.90 PDE3B (0.94) PDE3BPDE3AP2RY12MEN1PDE2A
Anagrelide SCHEMBL28341325 0.88 PDE3B (0.85) PDE3BPDE3AP2RY12MEN1PDE2A
Anagrelide SCHEMBL16335881 0.86 PDE3B (0.87) PDE3BPDE3AP2RY12MEN1PDE2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2486151-A1 ASSAYS FOR AGENTS AFFECTING MEGAKARYOCYTE DEVELOPMENT Shire Human Genetic Therapies (US) 2012-08-15 EP disclosed
WO-2011044162-A1 ASSAYS FOR AGENTS AFFECTING MEGAKARYOCYTE DEVELOPMENT SHIRE HUMAN GENETIC THERAPIES (US) 2011-04-14 WO disclosed