Teludipine

Teludipine

SCHEMBL9680668

Br.CCOC(=O)C1=C(C)NC(CN(C)C)=C(C(=O)OCC)C1c1ccccc1C=CC(=O)OC(C)(C)C

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

The experimentally established mechanism targets of Teludipine. 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
SLC6A2 known ✓ P23975 3/20 0.79
HTR1A known ✓ P08908 2/20 0.41
ADRA2A known ✓ P08913 2/20 0.41
ADRA1A known ✓ P35348 2/20 0.41
SLC6A3 known ✓ Q01959 2/20 0.41
ADRB2 known ✓ P07550 1/20 0.41
ADRB3 known ✓ P13945 1/20 0.41
ADRA2C known ✓ P18825 1/20 0.41
ADRA1D known ✓ P25100 1/20 0.41
ADRA1B known ✓ P35368 1/20 0.41
HTR3A known ✓ P46098 1/20 0.41
DRD3 P35462 3/20 0.79
KCNH2 Q12809 3/20 0.79
ADORA3 P0DMS8 2/20 0.79
OPRK1 P41145 2/20 0.79
CYP3A4 P08684 2/20 0.79
CYP2C9 P11712 2/20 0.79
CYP2C19 P33261 2/20 0.79
LMNA P02545 1/20 0.79
HTT P42858 1/20 0.79

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
Teludipine SCHEMBL1815862 0.99 SLC6A2 (0.80) SLC6A2DRD3KCNH2ADORA3OPRK1
Teludipine SCHEMBL9681046 0.99 SLC6A2 (0.80) SLC6A2DRD3KCNH2ADORA3OPRK1
Teludipine SCHEMBL122110 0.98 SLC6A2 (0.79) SLC6A2DRD3KCNH2ADORA3OPRK1
SCHEMBL9682241 0.96 ADORA3 (0.75) SLC6A2DRD3KCNH2ADORA3OPRK1
SCHEMBL9681754 0.90 SLC6A2 (0.78) SLC6A2DRD3KCNH2ADORA3OPRK1
Bromide SCHEMBL9679913 0.90 SLC6A2 (0.83) SLC6A2DRD3KCNH2ADORA3OPRK1
SCHEMBL9680051 0.89 SLC6A2 (0.85) SLC6A2DRD3KCNH2ADORA3OPRK1
SCHEMBL9680055 0.89 SLC6A2 (0.85) SLC6A2DRD3KCNH2ADORA3OPRK1
Lacidipine SCHEMBL29352892 0.89 CYP2C9 (1.00) SLC6A2DRD3KCNH2ADORA3OPRK1
Lacidipine SCHEMBL49277 0.89 CYP2C9 (1.00) SLC6A2DRD3KCNH2ADORA3OPRK1

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-5162345-A Dihydropyridinedicarboxylate Derivatives GLAXO, S.P.A. (IT) 1992-11-10 US disclosed