Sulfuric Acid

SCHEMBL6576616

CCCCCCCCCc1ccc(Oc2cc(N)c(CCCCCCCCC)c3c2CCO3)c2c1OCC2.CCCCCCCCCc1ccc(Oc2cc(N)c(CCCCCCCCC)c3c2CCO3)c2c1OCC2.O=S(=O)(O)O

nearest known ligand 0.34

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 Sulfuric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	LTB4R	Q15722	11/20	0.34

▸	LTB4R2	Q9NPC1	11/20	0.34

▸	HTR2A	P28223	1/20	0.32

▸	HTR2C	P28335	1/20	0.32

▸	HTR2B	P41595	1/20	0.32

▸	TSHR	P16473	1/20	0.31

▸	MEN1	O00255	1/20	0.30

▸	ALDH1A1	P00352	1/20	0.30

▸	KMT2A	Q03164	1/20	0.30

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
Sulfuric Acid SCHEMBL1424848	0.89	LTB4R (0.38)	LTB4RLTB4R2TSHRMEN1ALDH1A1
SCHEMBL1525666	0.82	HTR2A (0.37)	LTB4RLTB4R2HTR2AHTR2CHTR2B
SCHEMBL7934677	0.82	HTR2A (0.37)	LTB4RLTB4R2HTR2AHTR2CHTR2B
SCHEMBL3262720	0.82	HTR2A (0.37)	LTB4RLTB4R2HTR2AHTR2CHTR2B
SCHEMBL251633	0.82	HTR2A (0.37)	LTB4RLTB4R2HTR2AHTR2CHTR2B
SCHEMBL250560	0.82	HTR2A (0.37)	LTB4RLTB4R2HTR2AHTR2CHTR2B
Acetic Acid SCHEMBL4544163	0.80	LTB4R (0.42)	LTB4RLTB4R2TSHR
Phosphoric Acid SCHEMBL7706766	0.80	LTB4R (0.38)	LTB4RLTB4R2TSHRMEN1ALDH1A1
Acetic Acid SCHEMBL4551109	0.78	LTB4R (0.39)	LTB4RLTB4R2TSHRMEN1ALDH1A1
Acrylic Acid SCHEMBL1261322	0.77	THRB (0.43)	LTB4RLTB4R2TSHRMEN1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-0728822-B1	Aqueous paint composition	ROHM & HAAS (US)	2004-04-28	—	—	EP	disclosed
EP-0798350-B1	Paint composition	ROHM & HAAS (US)	1999-09-29	—	—	EP	disclosed
US-5705560-A	PAINTS, ANIONIC POLYMER	ROHM AND HAAS COMPANY (US)	1998-01-06	—	—	US	disclosed
EP-0798350-A1	Paint composition	ROHM AND HAAS COMPANY (US)	1997-10-01	—	—	EP	disclosed
EP-0728822-A2	Aqueous paint composition	ROHM AND HAAS COMPANY (US)	1996-08-28	—	—	EP	disclosed