Dyphylline

Dyphylline

SCHEMBL10890402

Cn1c(=O)c2[nH]cnc2n(C)c1=O.Cn1c(=O)c2[nH]cnc2n(C)c1=O.Cn1c(=O)c2c(ncn2CC(O)CO)n(C)c1=O

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PDE3APDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Dyphylline. 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
PDE4A known ✓ P27815 1/20 0.55
PDE4B known ✓ Q07343 1/20 0.55
PDE4C known ✓ Q08493 1/20 0.55
PDE4D known ✓ Q08499 1/20 0.55
LMNA P02545 5/20 0.78
SMN1; SMN2 Q16637 4/20 0.78
POLB P06746 2/20 0.78
ATAD2 Q6PL18 1/20 0.56
ADORA2B P29275 2/20 0.55
PIK3CD O00329 1/20 0.55
ALPL P05186 1/20 0.55
ADORA3 P0DMS8 1/20 0.55
TMIGD3 P0DMS9 1/20 0.55
ADORA2A P29274 1/20 0.55
ADORA1 P30542 1/20 0.55
CYP2C19 P33261 1/20 0.55
HIF1A Q16665 1/20 0.55
CYP1A2 P05177 1/20 0.54
MAPT P10636 1/20 0.54
RXFP1 Q9HBX9 4/20 0.53

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
Dyphylline SCHEMBL8720586 0.99 LMNA (0.77) LMNASMN1; SMN2POLBATAD2ADORA2B
Dyphylline SCHEMBL30434822 0.96 LMNA (0.72) LMNASMN1; SMN2POLBATAD2ADORA2B
Proxyphylline SCHEMBL28086639 0.89 LMNA (0.77) LMNASMN1; SMN2POLBATAD2ADORA2B
Dyphylline SCHEMBL1816552 0.89 LMNA (1.00) LMNASMN1; SMN2POLBADORA2BMAPT
Dyphylline SCHEMBL123781 0.89 LMNA (1.00) LMNASMN1; SMN2POLBADORA2BMAPT
Dyphylline SCHEMBL8192 0.89 LMNA (1.00) LMNASMN1; SMN2POLBADORA2BMAPT
Dyphylline SCHEMBL27937456 0.87 LMNA (0.97) LMNASMN1; SMN2POLBADORA2BMAPT
Dyphylline SCHEMBL5194181 0.84 LMNA (0.90) LMNASMN1; SMN2POLBADORA2BPIK3CD
Dyphylline SCHEMBL13724353 0.84 LMNA (0.90) LMNASMN1; SMN2POLBADORA2BMAPT
Dyphylline SCHEMBL28299816 0.84 LMNA (0.90) LMNASMN1; SMN2POLBADORA2BMAPT

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
US-4581359-A FOR BRONCHOPULMONARY INSUFFUCIENCY THE STATE OF OREGON ACTING BY AND THROUGH THE OREGON STATE BOARD OF HIGHER EDUCATION ON BEHALF OF OREGON STATE UNIVERSITY (US) 1986-04-08 US disclosed