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Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5604484

CC(C)CC1=C(c2cccc3ccccc23)c2ccccc2C1[Zr+2](C1C(CC(C)C)=C(c2cccc3ccccc23)c2ccccc21)=[Si](C)C.[Cl-].[Cl-]

nearest known ligand 0.31

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 7)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 known ✓ P23975 1/20 0.30
▸ SLC6A3 known ✓ Q01959 1/20 0.30
▸ NPC1 O15118 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ SLC6A4 P31645 2/20 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 SCHEMBL5604466 0.86 SLC6A4 (0.33) MAPTSLC6A4SLC6A2SLC6A3
Hydrochloric Acid SCHEMBL7936151 0.81 NPC1 (0.33) NPC1MAPTRAB9ASMN1; SMN2SLC6A4
Hydrochloric Acid SCHEMBL3759506 0.80 KDM4E (0.33) MAPTSLC6A4SLC6A2SLC6A3
Hydrochloric Acid SCHEMBL339001 0.80 KDM4E (0.33) MAPTSLC6A4SLC6A2SLC6A3
Hydrochloric Acid SCHEMBL4659102 0.77 NPC1 (0.30) NPC1MAPTRAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL3275850 0.76 SLC6A4 (0.32) SLC6A4
Hydrochloric Acid SCHEMBL2051250 0.72 NPC1 (0.32) NPC1MAPTRAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL5950993 0.72 ALDH1A1 (0.32) NPC1MAPTRAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL4658126 0.70 NPC1 (0.32) NPC1MAPTRAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL31571612 0.70 NPC1 (0.32) NPC1MAPTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7160949-B2 Olefin block copolymers, processes for producing the same and uses thereof MITSUI CHEMICALS, INC. (JP) 2007-01-09 — — US disclosed
EP-1275670-B1 OLEFIN BLOCK COPOLYMERS, PRODUCTION PROCESSES OF THE SAME AND USE THEREOF MITSUI CHEMICALS INC (JP) 2005-08-10 — — EP disclosed
US-20030055179-A1 Olefin block copolymers processes for producing the same and uses thereof MITSUI CHEMICALS, INC. (JP) 2003-03-20 — — US disclosed
EP-1275670-A1 OLEFIN BLOCK COPOLYMERS, PRODUCTION PROCESSES OF THE SAME AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2003-01-15 — — EP disclosed