Iodixanol

SCHEMBL28086309

CC(=O)N(CC(O)CN(C(C)=O)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I.COCC(O)CN(C(C)=O)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I

nearest known ligand 0.84

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	LMNA	P02545	2/20	0.84

▸	CYP2C19	P33261	1/20	0.80

▸	HIF1A	Q16665	1/20	0.80

▸	EGFR	P00533	1/20	0.32

▸	SRC	P12931	1/20	0.32

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
Iopentol SCHEMBL8845316	0.99	LMNA (0.82)	LMNACYP2C19HIF1AEGFRSRC
Iopentol SCHEMBL24471	0.99	LMNA (0.82)	LMNACYP2C19HIF1AEGFRSRC
Iopentol SCHEMBL14740647	0.98	CYP2C19 (0.84)	LMNACYP2C19HIF1AEGFRSRC
SCHEMBL9564078	0.95	LMNA (0.76)	LMNACYP2C19HIF1AEGFRSRC
SCHEMBL10058205	0.95	LMNA (0.76)	LMNACYP2C19HIF1AEGFRSRC
SCHEMBL3435296	0.93	LMNA (0.76)	LMNACYP2C19HIF1A
Iodixanol SCHEMBL37712	0.92	LMNA (1.00)	LMNACYP2C19HIF1AEGFRSRC
Iodixanol SCHEMBL21546	0.92	LMNA (1.00)	LMNACYP2C19HIF1AEGFRSRC
Iodixanol SCHEMBL8845042	0.92	LMNA (1.00)	LMNACYP2C19HIF1AEGFRSRC
SCHEMBL12855756	0.91	LMNA (0.84)	LMNACYP2C19HIF1AEGFRSRC

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-103717597-B	Heterocyclic compounds as kinase inhibitors	原真股份有限公司	2017-07-04	—	—	CN	disclosed
CN-103492389-B	Pyrazolo [4,3-d] pyrimidine as inhibitors of kinases	原真股份有限公司	2016-09-14	—	—	CN	disclosed