Halcinonide

SCHEMBL28142872

CC1(C)O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)CC[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@]2(C(=O)CCl)O1.C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CCl

nearest known ligand 0.76

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

NR3C1

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

Predicted protein targets (top 20)

	gene	UniProt	supporting neighbours	confidence
▸	NR3C1 known ✓	P04150	7/20	0.76

▸	CYP3A4	P08684	10/20	0.76

▸	PGR	P06401	5/20	0.76

▸	AR	P10275	3/20	0.76

▸	USP2	O75604	2/20	0.76

▸	HIF1A	Q16665	6/20	0.66

▸	LMNA	P02545	4/20	0.66

▸	NR1I2	O75469	1/20	0.66

▸	HSD17B10	Q99714	2/20	0.60

▸	TSHR	P16473	2/20	0.60

▸	NFKB1	P19838	2/20	0.60

▸	NPSR1	Q6W5P4	2/20	0.60

▸	MEN1	O00255	1/20	0.60

▸	CYP2D6	P10635	1/20	0.60

▸	KMT2A	Q03164	1/20	0.60

▸	APEX1	P27695	1/20	0.60

▸	PMP22	Q01453	1/20	0.60

▸	IKBKB	O14920	1/20	0.60

▸	CHUK	O15111	1/20	0.60

▸	ADRB2	P07550	1/20	0.60

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
Halcinonide SCHEMBL2637394	0.97	CYP3A4 (0.73)	CYP3A4NR3C1PGRARUSP2
Halcinonide SCHEMBL9810174	0.90	CYP3A4 (0.68)	CYP3A4NR3C1PGRARUSP2
SCHEMBL27385466	0.87	CYP3A4 (0.86)	CYP3A4NR3C1PGRARUSP2
Halcinonide SCHEMBL4335	0.87	NR3C1 (1.00)	CYP3A4NR3C1PGRARUSP2
Halcinonide SCHEMBL5489567	0.87	NR3C1 (1.00)	CYP3A4NR3C1PGRARUSP2
Halcinonide SCHEMBL24015431	0.87	NR3C1 (1.00)	CYP3A4NR3C1PGRARUSP2
Halcinonide SCHEMBL13026159	0.87	NR3C1 (1.00)	CYP3A4NR3C1PGRARUSP2
Halcinonide SCHEMBL7861670	0.87	NR3C1 (1.00)	CYP3A4NR3C1PGRARUSP2
Halcinonide SCHEMBL10019829	0.87	NR3C1 (1.00)	CYP3A4NR3C1PGRARUSP2
Halcinonide SCHEMBL4336	0.87	NR3C1 (1.00)	CYP3A4NR3C1PGRARUSP2

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-103717597-B	Heterocyclic compounds as kinase inhibitors	原真股份有限公司	2017-07-04	—	—	CN	disclosed