Cholesterol

SCHEMBL29094044

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.O=S(=O)(O)O.O=S(=O)(O)O

nearest known ligand 0.91

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA1A ADRA1B ADRA1D ADRA2A ADRA2B ADRA2C ADRB1 ADRB2 ADRB3 CALCRL CHRM1 CHRM2 CHRM3 F2R MAOA MAOB MAP2K1 MAP2K2 NTRK1 NTRK2 NTRK3 OPRD1 OPRK1 OPRM1 P2RY12 PKLR SCN10A SCN11A SCN1A SCN2A SCN3A SCN4A SCN5A SCN7A SCN8A SCN9A SLC18A2 SLC6A2 SLC6A3 TLR7 TLR9 TUBA1A TUBA1B TUBA1C TUBA3C TUBA3E TUBA4A TUBB TUBB1 TUBB2A TUBB2B TUBB3 TUBB4A TUBB4B TUBB6 TUBB8 dacA dacB dacC folA ftsI mrcA mrcB mrdA pol rplA rplB rplC rplD rplE rplF rplI rplJ rplK rplL rplM rplN rplO rplP rplQ rplR rplS rplT rplU rplV rplW rplX rplY rpmA rpmB rpmB1 rpmB2 rpmC rpmD rpmE rpmE2 rpmF rpmG rpmG1 rpmG2 rpmH rpmI rpmJ rpmJ2 rpsA rpsB rpsC rpsD rpsE rpsF rpsG rpsH rpsI rpsJ rpsK rpsL rpsM rpsN rpsO rpsP rpsQ rpsR rpsR1 rpsR2 rpsS rpsT rpsU rpsZ ykgM ykgO

The experimentally established mechanism targets of Cholesterol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 19)

	gene	UniProt	supporting neighbours	confidence
▸	OSBP	P22059	6/20	0.91

▸	RORC	P51449	5/20	0.91

▸	OSBP2	Q969R2	3/20	0.91

▸	CYP46A1	Q9Y6A2	2/20	0.91

▸	USP2	O75604	1/20	0.91

▸	LMNA	P02545	1/20	0.91

▸	ABCB1	P08183	1/20	0.91

▸	GRIN1	Q05586	5/20	0.78

▸	GRIN2A	Q12879	5/20	0.78

▸	NR1H3	Q13133	6/20	0.77

▸	CRYAB	P02511	1/20	0.74

▸	HMGCR	P04035	1/20	0.74

▸	ITGB3	P05106	1/20	0.74

▸	ITGAV	P06756	1/20	0.74

▸	SREBF2	Q12772	1/20	0.74

▸	NPC1L1	Q9UHC9	1/20	0.74

▸	GRIN2B	Q13224	4/20	0.73

▸	EPHA2	P29317	1/20	0.72

▸	DHCR24	Q15392	1/20	0.71

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.

Compound	similarity	top predicted	shared targets
Cholesterol SCHEMBL9458834	1.00	OSBP (0.91)	OSBPRORCOSBP2CYP46A1USP2
Cholesterol SCHEMBL192030	1.00	OSBP (0.91)	OSBPRORCOSBP2CYP46A1USP2
Cholesterol SCHEMBL26086800	1.00	OSBP (0.91)	OSBPRORCOSBP2CYP46A1USP2
Cholesterol SCHEMBL1965451	1.00	OSBP (0.91)	OSBPRORCOSBP2CYP46A1USP2
Cholesterol SCHEMBL27579873	1.00	OSBP (0.91)	OSBPRORCOSBP2CYP46A1USP2
Cholesterol SCHEMBL159924	0.99	OSBP (0.89)	OSBPRORCOSBP2CYP46A1USP2
Cholesterol SCHEMBL21879229	0.99	OSBP (0.89)	OSBPRORCOSBP2CYP46A1USP2
Cholesterol SCHEMBL2160402	0.99	OSBP (0.89)	OSBPRORCOSBP2CYP46A1USP2
Cholesterol SCHEMBL3792432	0.99	OSBP (0.89)	OSBPRORCOSBP2CYP46A1USP2
Cholesterol SCHEMBL27237461	0.99	OSBP (0.89)	OSBPRORCOSBP2CYP46A1USP2

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-116919989-A	Method for regulating vesicle distribution and therapeutic effect by using surface charge	中山大学	2023-10-24	—	—	CN	disclosed