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 | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | CCR1 | P32246 | 3/20 | 0.45 |
| ▸ | CCR5 | P51681 | 3/20 | 0.45 |
| ▸ | CCR8 | P51685 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | ALPL | P05186 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | ALPI | P09923 | 1/20 | 0.45 |
| ▸ | ALPG | P10696 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | METAP1 | P53582 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3690177 | 0.99 | KDM4E (0.46) | KDM4ESMN1; SMN2LMNACCR1CCR5 | |
| Bromide SCHEMBL3163536 | 0.96 | KDM4E (0.44) | KDM4ESMN1; SMN2LMNACCR1CCR5 | |
| Hydrochloric Acid SCHEMBL3167248 | 0.96 | KDM4E (0.44) | KDM4ESMN1; SMN2LMNACCR1CCR5 | |
| Hydrochloric Acid SCHEMBL3165680 | 0.96 | KDM4E (0.44) | KDM4ESMN1; SMN2LMNACCR1CCR5 | |
| Bromide SCHEMBL3166431 | 0.96 | KDM4E (0.44) | KDM4ESMN1; SMN2LMNACCR1CCR5 | |
| Hydrochloric Acid SCHEMBL3691622 | 0.84 | KDM4E (0.40) | KDM4ESMN1; SMN2LMNACCR1CCR5 | |
| Hydrochloric Acid SCHEMBL3698089 | 0.84 | KDM4E (0.40) | KDM4ESMN1; SMN2LMNACCR1CCR5 | |
| Bromide SCHEMBL3692550 | 0.84 | KDM4E (0.40) | KDM4ESMN1; SMN2LMNACCR1CCR5 | |
| Bromide SCHEMBL3692255 | 0.84 | KDM4E (0.40) | KDM4ESMN1; SMN2LMNACCR1CCR5 | |
| SCHEMBL8172159 | 0.83 | KDM4E (0.41) | KDM4ESMN1; SMN2LMNACCR1CCR5 |
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-7741240-B2 | Transition metal compounds for olefin polymerization and oligomerization | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2010-06-22 | — | — | US | disclosed |
| US-20080033125-A1 | Transition Metal Compounds for Olefin Polymerization and Oligomerization | EXXONMOBIL CHEMICAL PATENTS INC. | 2008-02-07 | — | — | US | disclosed |