Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5003672

CC1=C(c2cccc3cccnc23)CC([Cr+2])=C1Cc1cccc2ccccc12.[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
MAPK1 P28482 3/20 0.38
ADRA2A P08913 2/20 0.38
ADRA2B P18089 2/20 0.38
ADRA2C P18825 2/20 0.38
TAAR1 Q96RJ0 2/20 0.38
LMNA P02545 2/20 0.38
CYP2D6 P10635 2/20 0.38
MAPT P10636 2/20 0.38
HTR1A P08908 1/20 0.38
ADRA1A P35348 1/20 0.38
OPRM1 P35372 1/20 0.38
NISCH Q9Y2I1 1/20 0.38
CCR1 P32246 3/20 0.37
CCR8 P51685 3/20 0.37
CCR5 P51681 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 2/20 0.36
TSHR P16473 2/20 0.36
GLA P06280 1/20 0.36
P2RX7 Q99572 1/20 0.36

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 SCHEMBL5006801 0.84 P2RX7 (0.45) LMNACYP2D6MAPTADRA1ACCR1
Hydrochloric Acid SCHEMBL819634 0.80 CCR1 (0.40) LMNACYP2D6MAPTADRA1ACCR1
Hydrochloric Acid SCHEMBL4195070 0.77 TRPV1 (0.38) LMNACYP2D6MAPTADRA1ACCR1
Hydrochloric Acid SCHEMBL5009094 0.76 MAPT (0.38) MAPK1ADRA2AADRA2BADRA2CTAAR1
Hydrochloric Acid SCHEMBL5003132 0.76 PDE4A (0.40) MAPTP2RX7HSP90AA1
SCHEMBL27739271 0.76 CCR1 (0.38) LMNACYP2D6MAPTNISCHCCR1
Phenanthroline SCHEMBL17870543 0.74 LMNA (0.55) MAPK1ADRA2AADRA2BADRA2CTAAR1
Hydrochloric Acid SCHEMBL1072414 0.74 CCR1 (0.46) LMNACYP2D6MAPTADRA1ACCR1
Hydrochloric Acid SCHEMBL820330 0.74 LMNA (0.40) LMNACYP2D6MAPTADRA1ACCR1
SCHEMBL3086250 0.72 KDM4E (0.47) MAPK1LMNACYP2D6MAPTADRA1A

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-20080269445-A1 Monocyclopentadienyl Complexes BASELL POLYOLEFINE GMBH (DE) 2008-10-30 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-20080269445-A1 Monocyclopentadienyl Complexes PCBP1, COASY, PORCN MAPK1 3474/4885ADRA2A 4537/4885ADRA2B 4641/4885

“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.