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 | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | APAF1 | O14727 | 1/20 | 0.33 |
| ▸ | TDP2 | O95551 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 4/20 | 0.32 |
| ▸ | NPC1 | O15118 | 3/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3821780 | 0.79 | NPC1 (0.36) | SMN1; SMN2CYP2C9CYP2C19MAPTCYP1A2 | |
| Hydrochloric Acid SCHEMBL7257433 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL7247941 | 0.76 | RAB9A (0.32) | SMN1; SMN2CYP2C9CYP2C19MAPTCYP1A2 | |
| Hydrochloric Acid SCHEMBL7039631 | 0.71 | ADORA3 (0.32) | SMN1; SMN2RAB9APOLBLMNAADORA3 | |
| SCHEMBL29273718 | 0.56 | HDAC8 (0.60) | SMN1; SMN2ALDH1A1KMT2ARAB9ANPC1 | |
| Dibenzoylmethane SCHEMBL28456473 | 0.55 | KMT2A (0.59) | SMN1; SMN2CYP2C9CYP2C19MAPTCYP1A2 | |
| SCHEMBL4820895 | 0.54 | ALOX15 (0.61) | SMN1; SMN2MAPTALDH1A1KMT2ARAB9A | |
| SCHEMBL6100 | 0.54 | HDAC8 (0.62) | SMN1; SMN2MAPTALDH1A1KMT2ARAB9A | |
| SCHEMBL1005988 | 0.54 | ALDH1A1 (0.61) | SMN1; SMN2CYP2C9CYP2C19MAPTCYP1A2 | |
| Triphenylene SCHEMBL10947667 | 0.54 | MAPT (0.62) | SMN1; SMN2CYP2C19MAPTALDH1A1KMT2A |
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-6630545-B2 | Polymerization catalyst of a metal complex with anionic, polycyclic, fused ring ligand system containing at least 4 fused rings, a cocatalyst and a butadiene or pentadiene | THE DOW CHEMICAL COMPANY | 2003-10-07 | — | — | US | disclosed |
| US-20020037981-A1 | Polymerization catalyst of a metal complex with anionic, polycyclic, fused ring ligand system containing at least 4 fused rings, a cocatalyst and a butadiene or pentadiene | DOW CHEMICAL COMPANY | 2002-03-28 | — | — | US | disclosed |