Propane

Propane

SCHEMBL28284698

CCC.NNc1cc(Br)c(O)c(Br)c1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.42
▸ TDP1 Q9NUW8 3/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ ALDH1A1 P00352 3/20 0.40
▸ HIF1A Q16665 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ ALOX15 P16050 2/20 0.40
▸ ALOX12 P18054 2/20 0.40
▸ RECQL P46063 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ MAPT P10636 4/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ GFER P55789 2/20 0.36
▸ ESR1 P03372 1/20 0.36
▸ TTR P02766 2/20 0.35
▸ ALB P02768 1/20 0.35
▸ CA1 P00915 1/20 0.34

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
Propane SCHEMBL28549044 0.78 ALOX15 (0.43) TDP1ALDH1A1HSD17B10ALOX15ALOX12
Propane SCHEMBL6575912 0.74 ALOX5 (0.54) TSHRTDP1CYP3A4ALDH1A1HIF1A
SCHEMBL11719322 0.72 ACP1 (0.41) TSHRTDP1CYP3A4ALDH1A1MAPT
SCHEMBL8439142 0.72 TSHR (0.50) TSHRTDP1CYP3A4ALDH1A1HIF1A
SCHEMBL15227871 0.71 APEX1 (0.45) TDP1CYP3A4MAPTCA1CA2
SCHEMBL10554859 0.71 CYP3A4 (0.55) TSHRTDP1CYP3A4ALDH1A1HIF1A
SCHEMBL1250655 0.67 TSHR (0.50) TSHRTDP1CYP3A4ALDH1A1HIF1A
SCHEMBL28699193 0.67 CA2 (0.46) TSHRHSD17B10HPGDMAPTTTR
SCHEMBL3115237 0.65 LMNA (0.59) TSHRTDP1CYP3A4ALDH1A1HSD17B10
SCHEMBL3243859 0.65 ALDH1A1 (0.63) TSHRTDP1CYP3A4ALDH1A1HIF1A

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-109651628-B Carbon nanotube reinforced polycarbonate composite material and preparation method thereof 深圳烯湾科技有限公司 2021-04-13 — — CN disclosed
CN-109651628-A A kind of polycarbonate composite material and preparation method thereof of carbon nanotube enhancing 深圳烯湾科技有限公司 2019-04-19 — — CN disclosed
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