Olradipine

Olradipine

SCHEMBL9759987

CCOC(=O)C1=C(COCCOCCN)NC(C)=C(C(=O)OC)C1c1cccc(Cl)c1Cl.O=C(O)/C=C/C(=O)O

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol

The experimentally established mechanism targets of Olradipine. 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 2/20 0.75
KCNH2 known ✓ Q12809 2/20 0.75
ADRB2 known ✓ P07550 1/20 0.75
DRD2 known ✓ P14416 1/20 0.75
HTR2A known ✓ P28223 1/20 0.75
HTR2C known ✓ P28335 1/20 0.75
HTR2B known ✓ P41595 1/20 0.75
MEN1 known ✓ O00255 2/20 0.65
KMT2A known ✓ Q03164 2/20 0.65
TBXA2R P21731 3/20 0.75
ADRA1A P35348 3/20 0.75
SLC6A3 Q01959 3/20 0.75
ABCB11 O95342 3/20 0.75
ADORA3 P0DMS8 3/20 0.75
HTR1A P08908 2/20 0.75
ADRA2A P08913 2/20 0.75
CHRM1 P11229 2/20 0.75
DRD1 P21728 2/20 0.75
OPRM1 P35372 2/20 0.75
DRD3 P35462 2/20 0.75

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
Olradipine SCHEMBL9759998 1.00 TBXA2R (0.75) TBXA2RADRA1ASLC6A3ABCB11ADORA3
Olradipine SCHEMBL9760698 0.95 TBXA2R (0.83) TBXA2RADRA1ASLC6A3ABCB11ADORA3
Olradipine SCHEMBL1344914 0.95 TBXA2R (0.83) TBXA2RADRA1ASLC6A3ABCB11ADORA3
Olradipine SCHEMBL9760691 0.95 TBXA2R (0.83) TBXA2RADRA1ASLC6A3ABCB11ADORA3
Olradipine SCHEMBL30295459 0.95 TBXA2R (0.83) TBXA2RADRA1ASLC6A3ABCB11ADORA3
Olradipine SCHEMBL29597339 0.94 TBXA2R (0.81) TBXA2RADRA1ASLC6A3ABCB11ADORA3
Olradipine SCHEMBL1228947 0.94 TBXA2R (0.81) TBXA2RADRA1ASLC6A3ABCB11ADORA3
Fumaric Acid SCHEMBL9760654 0.94 TBXA2R (0.68) TBXA2RADRA1ASLC6A3ABCB11ADORA3
Fumaric Acid SCHEMBL9760678 0.94 TBXA2R (0.68) TBXA2RADRA1ASLC6A3ABCB11ADORA3
Fumaric Acid SCHEMBL9761428 0.93 TBXA2R (0.86) TBXA2RADRA1ASLC6A3ABCB11ADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5026863-A Medicinal products in racemic or enantiomorph form; calcium channel blockers. hypotensive agents, cardiovascular disorders ADIR ET COMPAGNIE (FR) 1991-06-25 US claimed
US-5026863-A Medicinal products in racemic or enantiomorph form; calcium channel blockers. hypotensive agents, cardiovascular disorders ADIR ET COMPAGNIE (FR) 1991-06-25 US disclosed
US-4983740-A Multistep; from 2- 2-/2-chloroethoxy/ethoxy!ethanol and potassium phthalimide ADIR ET COMPAGNIE (FR) 1991-01-08 US disclosed