Dodecane

Dodecane

SCHEMBL28229207

CCCCCCCCCCCC.CCCCCOc1ccccc1S(=O)(=O)O

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ NR1I2 O75469 1/20 0.55
▸ CHRM2 P08172 1/20 0.55
▸ CYP3A4 P08684 1/20 0.55
▸ ADRA2A P08913 1/20 0.55
▸ MAPT P10636 1/20 0.55
▸ OPRK1 P41145 1/20 0.55
▸ HTR2B P41595 1/20 0.55
▸ SLC6A3 Q01959 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ HDAC6 Q9UBN7 1/20 0.55
▸ S1PR3 Q99500 1/20 0.51
▸ TSHR P16473 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ CYSLTR2 Q9NS75 2/20 0.45
▸ CYSLTR1 Q9Y271 2/20 0.45
▸ SLC2A1 P11166 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45

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
SCHEMBL27577200 1.00 LMNA (0.55) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL6931173 1.00 LMNA (0.55) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL29671499 1.00 LMNA (0.55) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL7520068 1.00 LMNA (0.55) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL30876958 1.00 LMNA (0.55) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL727321 1.00 LMNA (0.55) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL179760 1.00 LMNA (0.55) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL8770368 1.00 LMNA (0.55) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL10885117 1.00 LMNA (0.55) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL30069222 0.98 LMNA (0.54) LMNAMEN1NR1I2CHRM2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108779448-A α -amylase combinatorial variants 丹尼斯科美国公司 2018-11-09 — — CN disclosed
CN-104080902-B composition and method for surface treatment with lipase 宝洁公司 2018-08-03 — — CN disclosed
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