Albuterol

Albuterol

SCHEMBL9238360

CC(C)(C)NCC(O)c1ccc(O)c(CO)c1.CC(C)NCC(O)c1cc(O)cc(O)c1

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB2

The experimentally established mechanism targets of Albuterol. 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 10/20 0.75
▸ HIF1A Q16665 5/20 0.75
▸ TSHR P16473 4/20 0.75
▸ ADRB1 P08588 4/20 0.75
▸ CYP1A2 P05177 2/20 0.75
▸ NFKB1 P19838 2/20 0.75
▸ CYP2D6 P10635 1/20 0.75
▸ TDP1 Q9NUW8 2/20 0.73
▸ PMP22 Q01453 1/20 0.67
▸ LMNA P02545 3/20 0.59
▸ KMT2A Q03164 3/20 0.59
▸ CYP3A4 P08684 2/20 0.59
▸ CASP7 P55210 2/20 0.59
▸ CYP2C9 P11712 1/20 0.59
▸ ADRA1A P35348 2/20 0.57
▸ MAPT P10636 2/20 0.53
▸ ADRB3 P13945 2/20 0.53
▸ MTOR P42345 2/20 0.53
▸ KDM4E B2RXH2 2/20 0.53
▸ MEN1 O00255 2/20 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
Levosalbutamol SCHEMBL18527021 1.00 ADRB2 (0.75) ADRB2HIF1ATSHRADRB1CYP1A2
Albuterol SCHEMBL328959 0.93 ADRB2 (0.87) ADRB2HIF1ATSHRADRB1CYP1A2
Albuterol SCHEMBL5657533 0.91 ADRB2 (0.79) ADRB2HIF1ATSHRADRB1CYP1A2
Terbutaline SCHEMBL1417928 0.88 ADRB2 (0.70) ADRB2HIF1ATSHRADRB1CYP1A2
Albuterol SCHEMBL9545560 0.87 ADRB2 (0.72) ADRB2HIF1ATSHRADRB1CYP1A2
Albuterol SCHEMBL2489838 0.87 ADRB2 (1.00) ADRB2HIF1ATSHRADRB1CYP1A2
Levosalbutamol SCHEMBL4003 0.87 ADRB2 (1.00) ADRB2HIF1ATSHRADRB1CYP1A2
Albuterol SCHEMBL121596 0.87 ADRB2 (1.00) ADRB2HIF1ATSHRADRB1CYP1A2
Albuterol SCHEMBL4913 0.87 ADRB2 (1.00) ADRB2HIF1ATSHRADRB1CYP1A2
Albuterol SCHEMBL122805 0.87 ADRB2 (1.00) ADRB2HIF1ATSHRADRB1CYP1A2

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
EP-0662324-A1 Use of beta-adrenergic agonists for treating loss of function of striated muscles The Rowett Research Institute (GB) 1995-07-12 — — EP claimed
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