R-Nadolol

R-Nadolol

SCHEMBL6508581

CC(C)(C)NCC(O)COc1cccc2c1C[C@H](O)[C@H](O)C2.CC(C)(C)NCC(O)COc1cccc2c1C[C@H](O)[C@H](O)C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1ADRB2

The experimentally established mechanism targets of R-Nadolol. 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
▸ ADRB2 known ✓ P07550 9/20 1.00
▸ ADRB1 known ✓ P08588 6/20 1.00
▸ TSHR P16473 2/20 1.00
▸ ADRA1A P35348 2/20 1.00
▸ LMNA P02545 2/20 1.00
▸ RECQL P46063 1/20 1.00
▸ HTR1A P08908 5/20 0.56
▸ SLC6A4 P31645 3/20 0.56
▸ ADRA2A P08913 3/20 0.56
▸ SLC6A2 P23975 2/20 0.56
▸ ADRB3 P13945 2/20 0.56
▸ SIGMAR1 Q99720 1/20 0.56
▸ OPRK1 P41145 1/20 0.55
▸ ADRA2B P18089 1/20 0.55
▸ MAOA P21397 1/20 0.55
▸ HTR2B P41595 1/20 0.55
▸ CYP2D6 P10635 3/20 0.55
▸ CYP1A2 P05177 2/20 0.55
▸ USP2 O75604 1/20 0.55
▸ CHRM1 P11229 1/20 0.55

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
R-Nadolol SCHEMBL4177 1.00 ADRB2 (1.00) ADRB2ADRB1TSHRADRA1ALMNA
R-Nadolol SCHEMBL30228708 1.00 ADRB2 (1.00) ADRB2ADRB1TSHRADRA1ALMNA
Nadolol SCHEMBL1134022 1.00 ADRB2 (1.00) ADRB2ADRB1TSHRADRA1ALMNA
S-Nadolol SCHEMBL124014 1.00 ADRB2 (1.00) ADRB2ADRB1TSHRADRA1ALMNA
R-Nadolol SCHEMBL17261862 1.00 ADRB2 (1.00) ADRB2ADRB1TSHRADRA1ALMNA
R-Nadolol SCHEMBL29687486 1.00 ADRB2 (1.00) ADRB2ADRB1TSHRADRA1ALMNA
R-Nadolol SCHEMBL1134021 1.00 ADRB2 (1.00) ADRB2ADRB1TSHRADRA1ALMNA
R-Nadolol SCHEMBL12493069 1.00 ADRB2 (1.00) ADRB2ADRB1TSHRADRA1ALMNA
R-Nadolol SCHEMBL29809024 1.00 ADRB2 (1.00) ADRB2ADRB1TSHRADRA1ALMNA
R-Nadolol SCHEMBL28846580 0.99 ADRB2 (0.98) ADRB2ADRB1TSHRADRA1ALMNA

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
WO-2005099699-A1 COMBINATION OF (S)-AMLODIPINE AND A BETA-BLOCKER, AND METHODS FOR REDUCING HYPERTENSION SEPRACOR INC. (US) 2005-10-27 — — WO disclosed
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