Hydrochloric Acid

Hydrochloric Acid

SCHEMBL30724641

CC(C)c1ccc(C2C=Cc3ccccc32)c(C(C)C)c1O.[Cl-].[Cl-].[Ti+2]

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Hydrochloric 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
SLC6A2 known ✓ P23975 1/20 0.39
GABRA1 P14867 2/20 0.39
GABRB2 P47870 2/20 0.39
FAAH O00519 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRG2 P18507 1/20 0.39
PTGS1 P23219 1/20 0.39
HTR2C P28335 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRA5 P31644 1/20 0.39
GABRA3 P34903 1/20 0.39
HTR2B P41595 1/20 0.39
GABRA2 P47869 1/20 0.39

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
Hydrochloric Acid SCHEMBL3355962 0.82 SIGMAR1 (0.32) SIGMAR1
SCHEMBL6399753 0.76 SIGMAR1 (0.38) GABRA1GABRB2FAAHCA1CA2
SCHEMBL4762075 0.70 ALDH1A1 (0.39) CA1CA2LMNACYP1A2CYP3A4
SCHEMBL28755427 0.69 NPC1 (0.33) SIGMAR1
SCHEMBL7778428 0.68 PNMT (0.35) CYP1A2CYP3A4HTR2BSIGMAR1
SCHEMBL10611980 0.68 GABRA1 (0.56) GABRA1GABRB2FAAHCA1CA2
SCHEMBL5158379 0.67 SIGMAR1 (0.36) SIGMAR1
SCHEMBL9062195 0.67 HTR2A (0.36) CA2LMNACYP1A2CYP3A4HPGD
SCHEMBL2830663 0.67 HTR2C (0.37) LMNACYP3A4TSHRSLC6A2HTR2C
Hydrochloric Acid SCHEMBL30769837 0.67 HTR2A (0.36) LMNACYP3A4SLC6A2HTR2CHTR2B

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117362502-A Method for preparing cycloolefin copolymer by adopting continuous flow integrated microreactor 浙江大学 2024-01-09 CN claimed
CN-117362502-A Method for preparing cycloolefin copolymer by adopting continuous flow integrated microreactor 浙江大学 2024-01-09 CN disclosed