Phosphoric Acid

SCHEMBL19197822

CCN(CC)CCCCC(C(=O)O)C(=O)O.N[C@H]1CC[C@@H](N)CC1.N[C@H]1CC[C@@H](N)CC1.N[C@H]1CC[C@@H](N)CC1.O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[Pt+2].[Pt+2].[Pt+2]

nearest known ligand 0.36

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
▸	ADRA1A known ✓	P35348	1/20	0.31

▸	OPRM1 known ✓	P35372	1/20	0.31

▸	KCNH2 known ✓	Q12809	1/20	0.31

▸	SIGMAR1	Q99720	1/20	0.36

▸	CHRM2	P08172	4/20	0.33

▸	CHRM1	P11229	4/20	0.33

▸	CHRM4	P08173	3/20	0.33

▸	CHRM3	P20309	3/20	0.33

▸	MMP8	P22894	2/20	0.32

▸	MMP2	P08253	1/20	0.32

▸	CYP3A4	P08684	2/20	0.31

▸	LMNA	P02545	2/20	0.31

▸	HTR1A	P08908	1/20	0.31

▸	ADRA2A	P08913	1/20	0.31

▸	DRD1	P21728	1/20	0.31

▸	SLC6A2	P23975	1/20	0.31

▸	DRD3	P35462	1/20	0.31

▸	SLC6A3	Q01959	1/20	0.31

▸	CYP1A2	P05177	1/20	0.31

▸	CYP2D6	P10635	1/20	0.31

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
Phosphoric Acid SCHEMBL19197823	0.99	SIGMAR1 (0.35)	SIGMAR1CHRM2CHRM1CHRM4CHRM3
SCHEMBL19197827	0.82	SIGMAR1 (0.39)	SIGMAR1CHRM2CHRM1CHRM4CHRM3
SCHEMBL19197984	0.81	SIGMAR1 (0.40)	SIGMAR1CHRM2CHRM1CHRM4CHRM3
SCHEMBL19197994	0.80	SIGMAR1 (0.37)	SIGMAR1CHRM2CHRM1CHRM4CHRM3
SCHEMBL19197988	0.80	SIGMAR1 (0.41)	SIGMAR1CHRM2CHRM1CHRM4CHRM3
SCHEMBL17102940	0.80	SIGMAR1 (0.50)	SIGMAR1CHRM2CHRM1CHRM4CHRM3
Water SCHEMBL28622482	0.78	SIGMAR1 (0.48)	SIGMAR1CHRM2CHRM1CHRM4CHRM3
Hydrochloric Acid SCHEMBL28600382	0.78	SIGMAR1 (0.48)	SIGMAR1CYP3A4LMNACYP1A2CYP2D6
Ethylenediamine SCHEMBL19197826	0.76	SIGMAR1 (0.43)	SIGMAR1CHRM2CHRM1CHRM4CHRM3
Acetic Acid SCHEMBL19197985	0.75	KMT2A (0.40)	SIGMAR1CHRM2CHRM1CHRM4CHRM3

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-2924044-B1	PLATINUM COMPOUND OF MALONIC ACID DERIVATIVE HAVING LEAVING GROUP CONTAINING AMINO OR ALKYLAMINO	BEIJING SHUOBAI PHARMACEUTICAL CO LTD (CN)	2018-10-31	—	—	EP	disclosed
US-9725477-B2	Platinum compounds of malonic acid derivative having leaving group containing amino or alkylamino	BEIJING FSWELCOME TECHNOLOGY DEVELOPMENT CO., LTD (CN)	2017-08-08	—	—	US	disclosed