Sugi Predict

Sugi Predict / Compounds / Hydrochloric Acid

Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6938442

CC(C)(C)c1cc(C2=Cc3cc([Si](C)(C)C)ccc3C2[Hf+2]C2C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=Cc3cc([Si](C)(C)C)ccc32)cc(C(C)(C)C)c1.[Cl-].[Cl-]

nearest known ligand 0.34

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 3)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 1/20 0.34
▸ S1PR3 Q99500 1/20 0.34
▸ KIF11 P52732 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 SCHEMBL6938318 0.85 KIF11 (0.34) S1PR1S1PR3KIF11
Hydrochloric Acid SCHEMBL6942775 0.83 S1PR1 (0.35) S1PR1S1PR3KIF11
Hydrochloric Acid SCHEMBL6938331 0.82 S1PR1 (0.33) S1PR1S1PR3
SCHEMBL6944473 0.81 S1PR1 (0.32) S1PR1S1PR3
SCHEMBL6944576 0.81 S1PR1 (0.32) S1PR1S1PR3
Hydrochloric Acid SCHEMBL6285166 0.80 S1PR1 (0.32) S1PR1S1PR3KIF11
SCHEMBL6943794 0.79 S1PR1 (0.31) S1PR1S1PR3
SCHEMBL6942779 0.79 S1PR1 (0.31) S1PR1S1PR3
Hydrochloric Acid SCHEMBL6937564 0.77 RXRB (0.31) —
Hydrochloric Acid SCHEMBL6941544 0.76 S1PR1 (0.33) S1PR1S1PR3

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-1157047-B1 LIGANDS AND CATALYSTS FOR PRODUCING ELASTOMERIC PROPYLENE POLYMERS BP CORP NORTH AMERICA INC (US) 2003-04-23 — — EP claimed
US-6479424-B1 FOR PRODUCING OLEFIN POLYMERS AND ESPECIALLY ELASTOMERIC PROPYLENE POLYMERS BP CORPORATION NORTH AMERICA INC. 2002-11-12 — — US claimed
EP-1157047-A1 LIGANDS AND CATALYSTS FOR PRODUCING ELASTOMERIC PROPYLENE POLYMERS BP Corporation North America Inc. (US) 2001-11-28 — — EP claimed
WO-2000035975-A1 LIGANDS AND CATALYSTS FOR PRODUCING ELASTOMERIC PROPYLENE POLYMERS BP CORPORATION NORTH AMERICA INC. (US) 2000-06-22 — — WO claimed
EP-1157047-A1 LIGANDS AND CATALYSTS FOR PRODUCING ELASTOMERIC PROPYLENE POLYMERS BP Corporation North America Inc. (US) 2001-11-28 — — EP disclosed
WO-2000035975-A1 LIGANDS AND CATALYSTS FOR PRODUCING ELASTOMERIC PROPYLENE POLYMERS BP CORPORATION NORTH AMERICA INC. (US) 2000-06-22 — — WO disclosed