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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.32 |
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.31 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.31 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.31 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.31 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.31 |
| ▸ | PSENEN | Q9NZ42 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4842777 | 0.88 | OPRK1 (0.32) | OPRK1SLC6A4SLC6A3KMT2AMAPK1 | |
| SCHEMBL9587131 | 0.87 | OPRK1 (0.33) | OPRK1SLC6A4SLC6A3KMT2AMAPK1 | |
| Hydrochloric Acid SCHEMBL218000 | 0.63 | — | — | |
| SCHEMBL6857281 | 0.63 | TSHR (0.34) | SLC6A4SLC6A3KMT2APOLBBCHE | |
| Hydrochloric Acid SCHEMBL215731 | 0.62 | HTT (0.31) | — | |
| Hydrochloric Acid SCHEMBL218104 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL216969 | 0.61 | HTT (0.30) | — | |
| SCHEMBL38651516 | 0.59 | BCHE (0.41) | SLC6A4SLC6A3BCHEACHE | |
| SCHEMBL25250940 | 0.58 | SLC6A4 (0.51) | SLC6A4SLC6A3KMT2ABCHEACHE | |
| Hydrochloric Acid SCHEMBL5852834 | 0.57 | CYP2C19 (0.41) | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6617466-B1 | Having a heteroatom ligand containing an element with a coordination number of three from Group V A or a coordination number of two from Group VI A attached to the ring through a hydrocarbylene, silane or germanium group | EXXONMOBIL CHEMICAL PATENTS INC. | 2003-09-09 | — | — | US | disclosed |
| US-5844055-A | Ethylene/branched olefin copolymers | EXXON CHEMICAL PATENTS INC. (US) | 1998-12-01 | — | — | US | disclosed |
| EP-0641362-B1 | ETHYLENE/BRANCHED OLEFIN COPOLYMERS | EXXON CHEMICAL PATENTS INC (US) | 1998-11-11 | — | — | EP | disclosed |
| EP-0616618-B1 | ETHYLENE/LONGER ALPHA-OLEFIN COPOLYMERS | EXXON CHEMICAL PATENTS INC (US) | 1997-07-02 | — | — | EP | disclosed |
| EP-0491842-B1 | MONOCYCLOPENTADIENYL TRANSITION METAL OLEFIN POLYMERIZATION CATALYSTS | EXXON CHEMICAL PATENTS INC (US) | 1997-04-09 | — | — | EP | disclosed |
| US-5475075-A | High molecular weight blends | EXXON CHEMICAL PATENTS INC. (US) | 1995-12-12 | — | — | US | disclosed |
| EP-0671404-A2 | Monocyclopentadienyl transition metal olefin polymerization catalysts | EXXON CHEMICAL PATENTS INC. (US) | 1995-09-13 | — | — | EP | disclosed |
| US-5444145-A | High molecular weight polymers with narrow molecular weight distribution, high strength, toughness | EXXON CHEMICAL PATENTS INC. (US) | 1995-08-22 | — | — | US | disclosed |
| EP-0643066-A2 | Monocyclopentadienyl transition metal olefin polymerization catalysts | EXXON CHEMICAL PATENTS INC. (US) | 1995-03-15 | — | — | EP | disclosed |
| EP-0641362-A1 | ETHYLENE/BRANCHED OLEFIN COPOLYMERS | EXXON CHEMICAL PATENTS INC. (US) | 1995-03-08 | — | — | EP | disclosed |
| EP-0616618-A1 | ETHYLENE/LONGER ALPHA-OLEFIN COPOLYMERS. | EXXON CHEMICAL PATENTS INC (US) | 1994-09-28 | — | — | EP | disclosed |
| WO-1993012151-A1 | ETHYLENE/LONGER ALPHA-OLEFIN COPOLYMERS | EXXON CHEMICAL PATENTS INC. (US) | 1993-06-24 | — | — | WO | disclosed |
| US-5096867-A | Polymer products of high molecular weight and narrow molecular weight distribution using small amounts of an alumoxane with the titanium complex | EXXON CHEMICAL PATENTS INC. (US) | 1992-03-17 | — | — | US | disclosed |