Terbutaline

Terbutaline

SCHEMBL1668880

CC(C)(C)NCC(O)c1cc(O)cc(O)c1.NC[C@H](O)c1ccc(O)c(O)c1

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB2

The experimentally established mechanism targets of Terbutaline. 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 5/20 0.67
KMT2A Q03164 5/20 0.67
HIF1A Q16665 4/20 0.67
LMNA P02545 3/20 0.67
CYP3A4 P08684 3/20 0.67
TSHR P16473 3/20 0.67
CASP7 P55210 2/20 0.67
CYP2C9 P11712 1/20 0.67
MEN1 O00255 4/20 0.59
BLM P54132 3/20 0.59
KDM4E B2RXH2 3/20 0.59
CASP1 P29466 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
TDP1 Q9NUW8 5/20 0.59
MAPT P10636 4/20 0.59
APEX1 P27695 3/20 0.59
RECQL P46063 3/20 0.59
ADRB1 P08588 3/20 0.59
HPGD P15428 2/20 0.59
ADRA2A P08913 2/20 0.59

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
Colterol SCHEMBL3220142 0.86 ADRB2 (0.72) ADRB2KMT2AHIF1ALMNACYP3A4
Colterol SCHEMBL3207818 0.86 ADRB2 (0.72) ADRB2KMT2AHIF1ALMNACYP3A4
Colterol SCHEMBL249585 0.86 ADRB2 (0.72) ADRB2KMT2AHIF1ALMNACYP3A4
Terbutaline SCHEMBL1417928 0.86 ADRB2 (0.70) ADRB2KMT2AHIF1ALMNACYP3A4
Terbutaline SCHEMBL4391 0.82 LMNA (1.00) ADRB2KMT2AHIF1ALMNACYP3A4
Terbutaline SCHEMBL13327959 0.82 LMNA (1.00) ADRB2KMT2AHIF1ALMNACYP3A4
Terbutaline SCHEMBL41869 0.82 LMNA (1.00) ADRB2KMT2AHIF1ALMNACYP3A4
Albuterol SCHEMBL328959 0.81 ADRB2 (0.87) ADRB2KMT2AHIF1ALMNACYP3A4
Terbutaline SCHEMBL8761821 0.80 BLM (0.67) ADRB2KMT2AHIF1ALMNACYP3A4
Terbutaline SCHEMBL404480 0.80 ADRB2 (0.96) ADRB2KMT2AHIF1ALMNACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2693883-A1 SILYL MONOMERS CAPABLE OF MULTIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME Cornell University (US) 2014-02-12 EP disclosed
EP-2694707-A1 MONOMERS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME Cornell University (US) 2014-02-12 EP disclosed
WO-2013058825-A1 SILYL MONOMERS CAPABLE OF MULTIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME CORNELL UNIVERSITY (US) 2013-04-25 WO disclosed
WO-2013058824-A1 MONOMERS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME CORNELL UNIVERSITY (US) 2013-04-25 WO disclosed
EP-2485678-A1 COFERONS AND METHODS OF MAKING AND USING THEM Cornell University (US) 2012-08-15 EP disclosed
WO-2011043817-A1 COFERONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2011-04-14 WO disclosed