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)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | CCR1 | P32246 | 2/20 | 0.43 |
| ▸ | CCR5 | P51681 | 2/20 | 0.43 |
| ▸ | CCR8 | P51685 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | METAP1 | P53582 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.43 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.43 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL787679 | 0.98 | TGFBR1 (0.46) | TGFBR1KDM4ELMNACCR1CCR5 | |
| Dipyridyl SCHEMBL4595525 | 0.97 | KDM4E (0.48) | TGFBR1KDM4ELMNACCR1CCR5 | |
| Hydrochloric Acid SCHEMBL1572132 | 0.97 | TGFBR1 (0.45) | TGFBR1KDM4ELMNACCR1CCR5 | |
| Dipyridyl SCHEMBL7511159 | 0.97 | KDM4E (0.48) | TGFBR1KDM4ELMNACCR1CCR5 | |
| SCHEMBL32689469 | 0.97 | TGFBR1 (0.45) | TGFBR1KDM4ELMNACCR1CCR5 | |
| SCHEMBL923478 | 0.93 | TGFBR1 (0.47) | TGFBR1KDM4ELMNACCR1CCR5 | |
| SCHEMBL29942138 | 0.93 | TGFBR1 (0.47) | TGFBR1KDM4ELMNACCR1CCR5 | |
| SCHEMBL2455952 | 0.92 | TGFBR1 (0.42) | TGFBR1KDM4ELMNACCR1CCR5 | |
| SCHEMBL6381236 | 0.89 | TGFBR1 (0.42) | TGFBR1KDM4ELMNACCR1CCR5 | |
| SCHEMBL31058350 | 0.85 | ULK1 (0.42) | TGFBR1KDM4ELMNACCR1CCR5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8462343-B2 | Wireless sensor system for environmental monitoring | UNIVERSITY OF MARYLAND BALTIMORE COUNTY (US) | 2013-06-11 | — | — | US | disclosed |
| US-20110235041-A1 | WIRELESS SENSOR SYSTEM FOR ENVIRONMENTAL MONITORING | UNIVERSITY OF MARYLAND BALTIMORE COUNTY | 2011-09-29 | — | — | US | disclosed |