Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6767390

O=C(Cl)c1ccncc1.[Cl-].[H+]

nearest known ligand 0.56

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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
▸ NAPRT Q6XQN6 1/20 0.56
▸ ALDH1A1 P00352 2/20 0.52
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ CYP1A2 P05177 2/20 0.48
▸ CYP3A4 P08684 2/20 0.48
▸ CYP2D6 P10635 2/20 0.48
▸ CYP2C19 P33261 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ MPO P05164 1/20 0.48
▸ ADORA3 P0DMS8 1/20 0.48
▸ CYP2A6 P11509 1/20 0.48
▸ GAA P10253 2/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ LTA4H P09960 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ MAOA P21397 1/20 0.45
▸ MAOB P27338 1/20 0.45
▸ PTGS2 P35354 1/20 0.45
▸ PLOD2 O00469 1/20 0.45

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
SCHEMBL2196 0.97 — —
SCHEMBL8016216 0.97 NAPRT (0.59) NAPRTALDH1A1MEN1KMT2ACYP1A2
Hydrochloric Acid SCHEMBL7300524 0.95 NAPRT (0.56) NAPRTALDH1A1MEN1KMT2ACYP1A2
Hydrochloric Acid SCHEMBL26328 0.95 NAPRT (0.56) NAPRTALDH1A1MEN1KMT2ACYP1A2
Hydrochloric Acid SCHEMBL28289025 0.84 NAPRT (0.46) NAPRTALDH1A1MEN1KMT2ACYP1A2
SCHEMBL6300124 0.83 HDAC1 (0.59) NAPRTALDH1A1KDM4ELTA4HLMNA
Benzoyl Chloride SCHEMBL587072 0.78 KMT2A (0.56) NAPRTALDH1A1MEN1KMT2ACYP1A2
SCHEMBL7461375 0.78 GAA (0.79) ALDH1A1MEN1KMT2AKDM4EGAA
SCHEMBL25202703 0.78 HDAC1 (0.65) NAPRTALDH1A1MEN1KMT2ACYP1A2
SCHEMBL19084903 0.78 HDAC1 (0.65) NAPRTALDH1A1MEN1KMT2ACYP1A2

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
CN-118204105-B Preparation method of desulfurization catalyst 烟台百川汇通科技有限公司 2024-07-16 — — CN disclosed
CN-118204105-A Preparation method of desulfurization catalyst 烟台百川汇通科技有限公司 2024-06-18 — — CN disclosed
CN-112279888-B Polypeptide inhibitor of APC/Asef interaction and application thereof 上海交通大学医学院 2022-09-13 — — CN disclosed
US-6716856-B1 CELL PROLIFERATIVE DISORDERS OR ALZHEIMER'S DISEASE; REDUCED TOXICITY; CDK/CYCLIN KINASE INHIBITORY ACTIVITY PHARMACIA & TUBJOHN SPA (IT) 2004-04-06 — — US disclosed
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