Phosphoric Acid

SCHEMBL5501494

CC1=CC(=O)C=C2CCC3C(C(O)C[C@@]4(C)C3CC[C@]4(O)C(=O)CO)[C@@]12C.CC1=CC(=O)C=C2CCC3C(C(O)C[C@@]4(C)C3CC[C@]4(O)C(=O)CO)[C@@]12C.CC1=CC(=O)C=C2CC[C@@H]3[C@H](C(O)C[C@@]4(C)[C@H]3CC[C@]4(O)C(=O)CO)[C@@]12C.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA1A ADRA1B ADRA1D ADRB1 ADRB2 ADRB3 CYP11B1 DPP4 FGFR1 FGFR2 FGFR3 FGFR4 HRH1 JAK1 JAK2 JAK3 KCNA1 KCNA10 KCNA2 KCNA3 KCNA4 KCNA5 KCNA6 KCNA7 KCNB1 KCNB2 KCNC1 KCNC2 KCNC3 KCNC4 KCND1 KCND2 KCND3 KCNF1 KCNG1 KCNG2 KCNG3 KCNG4 KCNH1 KCNH2 KCNH3 KCNH4 KCNH5 KCNH6 KCNH7 KCNH8 KCNQ1 KCNQ2 KCNQ3 KCNQ4 KCNQ5 KCNS1 KCNS2 KCNS3 KCNV1 KCNV2 KDR KIT NA OPRD1 OPRK1 OPRM1 P PDGFRB PIK3CD SCN10A SCN11A SCN1A SCN2A SCN3A SCN4A SCN5A SCN7A SCN8A SCN9A SMO TYK2 pol rplA rplB rplC rplD rplE rplF rplJ rplK rplL rplM rplN rplO rplP rplQ rplR rplS rplT rplU rplV rplW rplX rplY rpmA rpmB rpmC rpmD rpmE rpmF rpmG rpmH rpmI rpmJ rpsA rpsB rpsC rpsD rpsE rpsF rpsG rpsH rpsI rpsJ rpsK rpsL rpsM rpsN rpsO rpsP rpsQ rpsR rpsS rpsT rpsU ykgM ykgO

The experimentally established mechanism targets of Phosphoric Acid. 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	P04150	10/20	0.67

▸	HIF1A	Q16665	8/20	0.67

▸	HSD17B10	Q99714	6/20	0.67

▸	PGR	P06401	5/20	0.67

▸	CYP3A4	P08684	4/20	0.67

▸	CYP2C19	P33261	3/20	0.67

▸	SERPINA6	P08185	3/20	0.67

▸	NR3C2	P08235	2/20	0.67

▸	ABCB11	O95342	2/20	0.67

▸	AR	P10275	2/20	0.67

▸	TNF	P01375	1/20	0.67

▸	IL6	P05231	1/20	0.67

▸	GLUL	P15104	1/20	0.67

▸	ADAM17	P78536	1/20	0.67

▸	GPBAR1	Q8TDU6	1/20	0.67

▸	KMT2A	Q03164	2/20	0.63

▸	SHBG	P04278	1/20	0.63

▸	MAPT	P10636	1/20	0.63

▸	NFKB1	P19838	1/20	0.63

▸	SMN1; SMN2	Q16637	1/20	0.63

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
SCHEMBL1512721	0.96	HIF1A (0.72)	NR3C1HIF1AHSD17B10PGRCYP3A4
SCHEMBL2299293	0.96	HIF1A (0.72)	NR3C1HIF1AHSD17B10PGRCYP3A4
SCHEMBL13270299	0.96	HIF1A (0.72)	NR3C1HIF1AHSD17B10PGRCYP3A4
Phosphoric Acid SCHEMBL1929804	0.96	NR3C1 (0.64)	NR3C1HIF1AHSD17B10PGRCYP3A4
SCHEMBL719929	0.95	HIF1A (0.70)	NR3C1HIF1AHSD17B10PGRCYP3A4
Phosphoric Acid SCHEMBL1237365	0.95	NR3C1 (0.65)	NR3C1HIF1AHSD17B10PGRCYP3A4
Succinic Acid SCHEMBL7600416	0.92	HIF1A (0.66)	NR3C1HIF1AHSD17B10PGRCYP3A4
Succinic Acid SCHEMBL40948	0.91	HIF1A (0.64)	NR3C1HIF1AHSD17B10PGRCYP3A4
Succinic Acid SCHEMBL1477515	0.91	HIF1A (0.64)	NR3C1HIF1AHSD17B10PGRCYP3A4
Succinic Acid SCHEMBL7096415	0.90	HIF1A (0.63)	NR3C1HIF1AHSD17B10PGRCYP3A4

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
EP-1791525-A1	LIPOSOMAL COMPOSITIONS OF GLUCOCORTICOID AND GLUCOCORTICOID DERIVATIVES	YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL)	2007-06-06	—	—	EP	disclosed
WO-2006027787-A1	LIPOSOMAL COMPOSITIONS OF GLUCOCORTICOID AND GLUCOCORTICOID DERIVATIVES	YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL)	2006-03-16	—	—	WO	disclosed