Phosphoric Acid

Phosphoric Acid

SCHEMBL10864885

Cc1cccc(C(=O)CN2C=CN(C)C2)c1.Cc1cccc(C(=O)CN2C=CN(C)C2)c1.Cc1cccc(C(=O)CN2C=CN(C)C2)c1.O=P(O)(O)O

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

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 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 known ✓ Q12809 1/20 0.38
▸ HPGD P15428 2/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ CTNNB1 P35222 2/20 0.40
▸ WNT3A P56704 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ ALDH3A1 P30838 1/20 0.39
▸ TAS1R3 Q7RTX0 1/20 0.39
▸ TAS1R1 Q7RTX1 1/20 0.39
▸ PARP1 P09874 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ SLC6A2 P23975 1/20 0.38
▸ SLC6A4 P31645 1/20 0.38
▸ SLC6A3 Q01959 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ GRIN2B Q13224 1/20 0.38
▸ KCNK3 O14649 1/20 0.38
▸ KCNK9 Q9NPC2 1/20 0.38

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
SCHEMBL10529171 0.95 CTNNB1 (0.43) HPGDTDP1HDAC8HDAC6CTNNB1
SCHEMBL30278566 0.95 CTNNB1 (0.43) HPGDTDP1HDAC8HDAC6CTNNB1
Bromide SCHEMBL10528581 0.93 CTNNB1 (0.42) HPGDTDP1HDAC8HDAC6CTNNB1
Phosphoric Acid SCHEMBL10529465 0.84 MAPT (0.47) HPGDCTNNB1WNT3AALDH1A1TAS1R3
SCHEMBL28841334 0.80 CXCR3 (0.50) HPGDALDH1A1PARP1SLC6A2SLC6A4
SCHEMBL29794039 0.80 CXCR3 (0.50) HPGDALDH1A1PARP1SLC6A2SLC6A4
Iodide SCHEMBL27281690 0.79 TPMT (0.36) HPGDALDH1A1GRIN2BMEN1KMT2A
SCHEMBL28841390 0.79 ALDH1A1 (0.44) HPGDTDP1ALDH1A1SMN1; SMN2SLC6A4
SCHEMBL10531109 0.78 MAPT (0.51) HPGDCTNNB1WNT3AALDH1A1PARP1
SCHEMBL10531146 0.78 KMT2A (0.50) HDAC6ALDH1A1SMN1; SMN2GRIN2BMEN1

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-4609670-A ANTIDIABETIC AGENTS ELI LILLY AND COMPANY (US) 1986-09-02 — — US disclosed
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