Picumeterol

Picumeterol

SCHEMBL9858096

Nc1c(Cl)cc([C@@H](O)CNCCCCCCOCCc2ccccn2)cc1Cl.O=C(O)/C=C/C(=O)O

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol

The experimentally established mechanism targets of Picumeterol. 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 16/20 0.44
▸ ADRB1 known ✓ P08588 13/20 0.44
▸ SLC6A2 known ✓ P23975 2/20 0.41
▸ HTR2A known ✓ P28223 2/20 0.41
▸ SLC6A4 known ✓ P31645 2/20 0.41
▸ DRD2 known ✓ P14416 1/20 0.41
▸ HTR2C known ✓ P28335 1/20 0.41
▸ HTR2B known ✓ P41595 1/20 0.41
▸ KCNH2 known ✓ Q12809 1/20 0.41
▸ MEN1 known ✓ O00255 1/20 0.41
▸ KMT2A known ✓ Q03164 1/20 0.41
▸ MLNR known ✓ O43193 1/20 0.39
▸ SLC2A1 P11166 1/20 0.68
▸ ADRB3 P13945 13/20 0.44
▸ ADRA1A P35348 2/20 0.41
▸ SLC6A3 Q01959 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ HTR1A P08908 1/20 0.41
▸ CHRM5 P08912 1/20 0.41
▸ ADRA2B P18089 1/20 0.41

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
Picumeterol SCHEMBL666136 1.00 SLC2A1 (0.68) SLC2A1ADRB2ADRB1ADRB3SLC6A2
Fumaric Acid SCHEMBL9857939 0.93 SLC2A1 (0.59) SLC2A1ADRB2ADRB1ADRB3SLC6A2
SCHEMBL10416913 0.93 SLC2A1 (0.57) SLC2A1ADRB2ADRB1ADRB3SLC6A2
Picumeterol SCHEMBL9857897 0.93 SLC2A1 (0.57) SLC2A1ADRB2ADRB1ADRB3SLC6A2
Picumeterol SCHEMBL83175 0.93 SLC2A1 (0.57) SLC2A1ADRB2ADRB1ADRB3SLC6A2
Picumeterol SCHEMBL29414334 0.93 SLC2A1 (0.57) SLC2A1ADRB2ADRB1ADRB3SLC6A2
Picumeterol SCHEMBL156907 0.93 SLC2A1 (0.57) SLC2A1ADRB2ADRB1ADRB3SLC6A2
SCHEMBL10391329 0.92 SLC2A1 (0.57) SLC2A1ADRB2ADRB1ADRB3SLC6A2
SCHEMBL9741835 0.89 SLC2A1 (0.57) SLC2A1ADRB2ADRB1ADRB3SLC6A2
SCHEMBL10416519 0.89 SLC2A1 (0.59) SLC2A1ADRB2ADRB1ADRB3SLC6A2

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-0460924-A1 Dichloroaniline compound GLAXO GROUP LIMITED (GB) 1991-12-11 — — EP disclosed
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