Phosphoric Acid

Phosphoric Acid

SCHEMBL9856725

CCCOc1ccccc1C(CCNC)Cc1cc(C)cc(CC)c1.CCCOc1ccccc1C(CCNC)Cc1cc(C)cc(CC)c1.O=P(O)(O)O

nearest known ligand 0.36

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Known targets — ChEMBL curated mechanism

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

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 18)

geneUniProtsupporting neighboursconfidence
ADRB2 known ✓ P07550 1/20 0.33
ADRB1 known ✓ P08588 1/20 0.33
ADRB3 known ✓ P13945 1/20 0.33
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
S1PR2 O95136 7/20 0.34
S1PR1 P21453 7/20 0.34
S1PR3 Q99500 7/20 0.34
LPAR2 Q9HBW0 7/20 0.34
PPARG P37231 2/20 0.33
LMNA P02545 3/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 2/20 0.33
HIF1A Q16665 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HTR7 P34969 1/20 0.32

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL9856730 0.82 MEN1 (0.35) MEN1KMT2APPARGLMNAMAPT
Sulfuric Acid SCHEMBL9856834 0.70 ALOX15 (0.42) KMT2ALMNAMAPTTSHR
SCHEMBL11076821 0.62 ALOX15 (0.42) MEN1KMT2APPARGLMNAMAPT
Benzoic Acid SCHEMBL9856985 0.62 SLC6A2 (0.43) MEN1KMT2ALMNATSHRADRB2
SCHEMBL9856763 0.61 SLC6A4 (0.44) KMT2AKDM4E
SCHEMBL11072867 0.61 TNF (0.47) MEN1KMT2APPARGLMNAMAPT
SCHEMBL11078352 0.61 CYP1A2 (0.44) MEN1KMT2ALMNAMAPTNPSR1
Oxalic Acid SCHEMBL10595045 0.60 CTSB (0.46) MEN1KMT2AMAPTKDM4E
SCHEMBL23095838 0.60 PPARG (0.46) PPARGLMNAMAPTNPSR1ADRB2
SCHEMBL9857036 0.60 HTR2A (0.49) MEN1KMT2ALMNATSHRADRB2

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4996235-A Selectively inhibiting the uptake of serotonin and norepinephrine ELI LILLY AND COMPANY (US) 1991-02-26 US disclosed