Bisphenol A — predicted protein targets

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 Bisphenol A. 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
▸	ESR1	P03372	10/20	0.59

▸	ESR2	Q92731	9/20	0.59

▸	ESRRG	P62508	4/20	0.59

▸	CYP3A4	P08684	3/20	0.59

▸	AR	P10275	1/20	0.59

▸	HPGD	P15428	1/20	0.59

▸	TSHR	P16473	1/20	0.59

▸	SLC6A2	P23975	1/20	0.59

▸	SLC6A4	P31645	1/20	0.59

▸	HTR6	P50406	1/20	0.59

▸	SLC6A3	Q01959	1/20	0.59

▸	HSD17B10	Q99714	1/20	0.59

▸	ALDH1A1	P00352	2/20	0.52

▸	LMNA	P02545	1/20	0.43

▸	TYR	P14679	1/20	0.43

▸	SHBG	P04278	1/20	0.41

▸	MEN1	O00255	2/20	0.41

▸	KMT2A	Q03164	2/20	0.41

▸	KDM4E	B2RXH2	1/20	0.41

▸	ESRRB	O95718	1/20	0.40

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
Bisphenol A SCHEMBL10866614	0.90	ESR1 (0.73)	ESR1ESR2ESRRGCYP3A4AR
Bisphenol A SCHEMBL29411202	0.88	ESR1 (0.76)	ESR1ESR2ESRRGCYP3A4AR
Bisphenol A SCHEMBL9280917	0.88	ESR1 (0.76)	ESR1ESR2ESRRGCYP3A4AR
Bisphenol A SCHEMBL3075715	0.85	ESR1 (0.64)	ESR1ESR2ESRRGCYP3A4AR
Bisphenol A SCHEMBL1263188	0.84	ESR1 (0.48)	ESR1ESR2ESRRGCYP3A4AR
Bisphenol A SCHEMBL28078247	0.81	ESR1 (0.64)	ESR1ESR2ESRRGCYP3A4AR
Bisphenol A SCHEMBL1610311	0.81	ESR1 (0.73)	ESR1ESR2ESRRGCYP3A4AR
Bisphenol A SCHEMBL29461347	0.81	ESR1 (0.64)	ESR1ESR2ESRRGCYP3A4AR
Bisphenol A SCHEMBL30912031	0.80	ESR1 (0.70)	ESR1ESR2ESRRGCYP3A4AR
Bisphenol A SCHEMBL17728808	0.78	ESR1 (0.73)	ESR1ESR2ESRRGCYP3A4AR

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-110494538-B	Lubricant composition for wristwatch, treatment liquid for wristwatch lubrication, and wristwatch	西铁城时计株式会社	2022-10-25	—	—	CN	disclosed
CN-107529859-B	Timepiece member, timepiece, and method of manufacturing timepiece member	西铁城时计株式会社	2020-03-31	—	—	CN	disclosed
CN-110494538-A	The treatment fluid and wrist-watch of the lubricant compositions of wrist-watch, wrist-watch lubrication	CITIZEN WATCH CO LTD	2019-11-22	—	—	CN	disclosed
CN-104937083-A	CLOCK LUBRICATING-OIL COMPOSITION AND CLOCK	CITIZEN HOLDINGS CO LTD	2015-09-23	—	—	CN	disclosed
CN-102264881-A	Lubrication kit and small electronic device utilizing the lubrication kit	—	2011-11-30	—	—	CN	disclosed
US-20080292981-A1	IMAGE BEARING MEMBER AND IMAGE FORMING APPARATUS USING THE SAME	RICOH COMPANY LIMITED (JP)	2008-11-27	—	—	US	disclosed