Hydrochloric Acid

Hydrochloric Acid

SCHEMBL10323010

Cc1ccc(CC2([Ti+3])C=CC=C2)c(C)c1.[Cl-].[Cl-].[Cl-]

nearest known ligand 0.38

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
KMT2A Q03164 3/20 0.38
PYCR1 P32322 1/20 0.36
RAB9A P51151 2/20 0.35
LMNA P02545 2/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPC1 O15118 1/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
TP53 P04637 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
MAPT P10636 3/20 0.32
MEN1 O00255 2/20 0.32
TNF P01375 1/20 0.32
USP2 O75604 1/20 0.32
GAA P10253 1/20 0.32
CASP1 P29466 1/20 0.32
HBB P68871 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
NR3C1 P04150 1/20 0.31

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 SCHEMBL10324032 0.86 TAAR1 (0.43) KMT2ARAB9ALMNAHTTNPC1
Hydrochloric Acid SCHEMBL10323143 0.79
Hydrochloric Acid SCHEMBL10324023 0.79
Hydrochloric Acid SCHEMBL10323046 0.78 TAAR1 (0.39) KMT2ARAB9ALMNAHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL10323844 0.76 HTR1D (0.36)
Hydrochloric Acid SCHEMBL10323739 0.76 KMT2A (0.34) KMT2APYCR1MAPTMEN1KDM4A
Hydrochloric Acid SCHEMBL10323309 0.73 IDO1 (0.38) RAB9ASMN1; SMN2NPC1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL10323199 0.73 TAAR1 (0.44) KMT2AMEN1TAAR1NR3C2
Hydrochloric Acid SCHEMBL10323087 0.69 CYP11B1 (0.32)
Hydrochloric Acid SCHEMBL10324426 0.68 TAAR1 (0.36) ALDH1A1TAAR1

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
US-20140012056-A1 METHOD FOR PRODUCING 1-HEXENE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-09 US disclosed
US-20120184693-A1 ETHYLENE POLYMER PREPARATION METHOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140012056-A1 METHOD FOR PRODUCING 1-HEXENE AP2A1, AP1M1, ME1 KMT2A 2582/4885PYCR1 2781/4885RAB9A 3927/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.