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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 2/20 | 0.35 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7691868 | 0.96 | POLB (0.38) | HTR1DPOLBTSHRACHEPTGS2 | |
| SCHEMBL6354922 | 0.94 | POLB (0.37) | HTR1DPOLBTSHRACHEPTGS2 | |
| Tetrahydrofuran SCHEMBL7687279 | 0.84 | HTR1D (0.33) | HTR1DPOLBTSHRALDH1A1P2RX7 | |
| Tetrahydrofuran SCHEMBL7687277 | 0.80 | LMNA (0.33) | POLBTSHRALDH1A1P2RX7 | |
| SCHEMBL7686136 | 0.72 | KMT2A (0.41) | ACHEPTGS2ALDH1A1SMN1; SMN2 | |
| SCHEMBL7686146 | 0.70 | TSHR (0.35) | TSHRHTT | |
| SCHEMBL6676436 | 0.69 | CYP1A2 (0.39) | HTR1DPOLBTSHRACHEALDH1A1 | |
| SCHEMBL5139613 | 0.69 | CYP1A2 (0.39) | HTR1DPOLBTSHRACHEALDH1A1 | |
| SCHEMBL7105315 | 0.66 | ALDH1A1 (0.43) | TSHRPTGS2ALDH1A1SMN1; SMN2ALOX12 | |
| SCHEMBL7109817 | 0.66 | HTR1D (0.36) | HTR1DPOLBTSHRACHEALDH1A1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6335303-B1 | EFFECTIVE IN POLYMERIZATION OF ALPHA OLEFINS TO HIGH MOLECULAR WEIGHT POLYMERS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2002-01-01 | — | — | US | claimed |
| WO-1998045039-A1 | POLYMERIZATION CATALYSTS CONTAINING ELECTRON-WITHDRAWING AMIDE LIGANDS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1998-10-15 | — | — | WO | claimed |
| US-20050090383-A1 | Metal complex compositions and their use as catalysts to produce polydienes | THIELE SVEN K (DE) | 2005-04-28 | — | — | US | disclosed |
| EP-1436332-A2 | METAL COMPLEX COMPOSITIONS AND THEIR USE AS CATALYSTS TO PRODUCE POLYDIENES | DOW GLOBAL TECHNOLOGIES INC. (US) | 2004-07-14 | — | — | EP | disclosed |
| WO-2003033545-A2 | METAL COMPLEX COMPOSITIONS AND THEIR USE AS CATALYSTS TO PRODUCE POLYDIENES | DOW GLOBAL TECHNOLOGIES INC. (US) | 2003-04-24 | — | — | WO | disclosed |
| US-6335303-B1 | EFFECTIVE IN POLYMERIZATION OF ALPHA OLEFINS TO HIGH MOLECULAR WEIGHT POLYMERS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2002-01-01 | — | — | US | disclosed |
| WO-1998045039-A1 | POLYMERIZATION CATALYSTS CONTAINING ELECTRON-WITHDRAWING AMIDE LIGANDS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1998-10-15 | — | — | WO | disclosed |