Cimaterol

Cimaterol

SCHEMBL8927440

CC(C)NCC(O)c1ccc(N)c(C#N)c1.CC(C)NCC(O)c1ccc(N)c(C#N)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 4/20 1.00
ADRB1 P08588 4/20 1.00
TSHR P16473 4/20 1.00
ADRB3 P13945 3/20 1.00
MAPK1 P28482 3/20 1.00
CYP1A2 P05177 3/20 1.00
CYP3A4 P08684 2/20 1.00
MAPT P10636 3/20 0.54
MTOR P42345 2/20 0.54
KDM4E B2RXH2 2/20 0.54
HSD17B10 Q99714 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
HIF1A Q16665 2/20 0.54
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
HPGD P15428 1/20 0.54
NFKB1 P19838 1/20 0.54
CYP2C19 P33261 1/20 0.54

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
Cimaterol SCHEMBL250088 1.00 ADRB2 (1.00) ADRB2ADRB1TSHRADRB3MAPK1
SCHEMBL10420798 0.88 ADRB2 (0.78) ADRB2ADRB1TSHRADRB3MAPK1
SCHEMBL4627874 0.88 ADRB2 (0.78) ADRB2ADRB1TSHRADRB3MAPK1
Cimaterol SCHEMBL29576402 0.84 ADRB2 (0.72) ADRB2ADRB1TSHRADRB3MAPK1
SCHEMBL11640157 0.84 ADRB2 (0.72) ADRB2ADRB1TSHRADRB3MAPK1
Ractopamine SCHEMBL10591006 0.84 ADRB2 (0.70) ADRB2ADRB1TSHRADRB3MAPK1
SCHEMBL9706014 0.83 ADRB2 (0.71) ADRB2ADRB1TSHRADRB3MAPK1
SCHEMBL10659631 0.82 TSHR (0.69) ADRB2ADRB1TSHRADRB3MAPK1
SCHEMBL9706066 0.82 ADRB2 (0.69) ADRB2ADRB1TSHRADRB3MAPK1
SCHEMBL12648693 0.82 TSHR (0.68) ADRB2ADRB1TSHRADRB3MAPK1

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
CN-109100439-A 5 kinds of remaining detection methods of beta-receptor agonist in a kind of pork liver, beef and mutton 连云港市畜产品质量监督检验测试中心 2018-12-28 CN claimed
CN-109100439-A 5 kinds of remaining detection methods of beta-receptor agonist in a kind of pork liver, beef and mutton 连云港市畜产品质量监督检验测试中心 2018-12-28 CN disclosed
CN-104502429-B The preparation method and application of unmarked electrogenerated chemiluminescence clenbuterol hydrochloride immunosensor UNIVERSITY OF JINAN (CN) 2015-10-21 CN disclosed
CN-104502429-A Preparation method for unmarked electrogenerated chemiluminescence clenbuterol immune sensor and application thereof UNIV JINAN 2015-04-08 CN disclosed
US-5648386-A Separation of enantiomers of cimaterol, (-)-cimaterol and the use thereof in pharmaceutical compositions and animal feeds BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1997-07-15 US disclosed
US-5292753-A Separation of enantiomers of cimaterol, (-)-cimaterol and the use thereof in pharmaceutical compositions and animal feeds BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1994-03-08 US disclosed