Hydrochloric Acid

Hydrochloric Acid

SCHEMBL16236422

CC(=O)Oc1ccc(C)c(C)c1-c1c(O[Ti+3])ccc(C)c1C.[Cl-].[Cl-].[Cl-]

nearest known ligand 0.44

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 18)

geneUniProtsupporting neighboursconfidence
▸ ACHE known ✓ P22303 2/20 0.41
▸ PTPN1 P18031 1/20 0.44
▸ PIM1 P11309 1/20 0.41
▸ TSHR P16473 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ NCEH1 Q6PIU2 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ GBA1 P04062 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ CFD P00746 1/20 0.37
▸ NR3C1 P04150 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ ELANE P08246 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TNFSF11 O14788 1/20 0.35

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
SCHEMBL16236880 0.86 TSHR (0.47) PTPN1ACHEPIM1TSHRALDH1A1
Hydrochloric Acid SCHEMBL16237201 0.83 ELANE (0.41) ALDH1A1NCEH1ELANELMNA
SCHEMBL16236511 0.81 PIM1 (0.58) PTPN1ACHEPIM1TSHRALDH1A1
Hydrochloric Acid SCHEMBL16236357 0.81 PTPN1 (0.43) PTPN1ACHEPIM1TSHRALDH1A1
Hydrochloric Acid SCHEMBL16237107 0.80 POLB (0.47) TSHRGAAKMT2APOLBLMNA
Hydrochloric Acid SCHEMBL16239740 0.80 PTPN1 (0.44) PTPN1ACHEPIM1TSHRALDH1A1
Hydrochloric Acid SCHEMBL16236353 0.79 MEN1 (0.45) ACHETSHRKDM4ERAB9ANCEH1
SCHEMBL16236329 0.79 PTPN1 (0.43) PTPN1ACHEPIM1TSHRALDH1A1
Hydrochloric Acid SCHEMBL16239157 0.78 KMT2A (0.45) ACHEKDM4EKMT2A
SCHEMBL16237634 0.78 PTPN1 (0.46) PTPN1ACHEPIM1TSHRALDH1A1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2997050-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2018-01-17 — — EP disclosed
US-9714303-B2 Catalyst components for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2017-07-25 — — US disclosed
US-20160115261-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia, s.r.l. (IT) 2016-04-28 — — US disclosed
EP-2997050-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2016-03-23 — — EP disclosed
WO-2014184171-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2014-11-20 — — WO disclosed
EP-2803678-A1 Catalyst components for the polymerization of olefins Basell Poliolefine Italia S.r.l. (IT) 2014-11-19 — — EP disclosed
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