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 | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | FDPS | P14324 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7158867 | 0.67 | PTPN1 (0.58) | PTPN1FDPSTSHRPTPN5CA2 | |
| Hydrochloric Acid SCHEMBL8009761 | 0.62 | PTPN1 (0.35) | PTPN1FDPSTSHRPTPN5CA2 | |
| SCHEMBL1099732 | 0.59 | PTPN1 (0.58) | PTPN1FDPSTSHRPTPN5CA2 | |
| SCHEMBL875768 | 0.59 | PTPN1 (0.58) | PTPN1FDPSSRCTSHRPTPN5 | |
| SCHEMBL2419565 | 0.57 | PTPN1 (0.50) | PTPN1FDPSSRCPTPN5ALDH1A1 | |
| SCHEMBL7232658 | 0.57 | PTPN1 (0.56) | PTPN1FDPSTSHRPTPN5CA2 | |
| SCHEMBL9849577 | 0.56 | FDPS (0.58) | PTPN1FDPSPTPN5 | |
| Tert-Butylbenzene SCHEMBL28656247 | 0.56 | PTPN1 (0.54) | PTPN1CA2CA4CA5AALDH1A1 | |
| Tert-Butylbenzene SCHEMBL6285328 | 0.56 | PTPN1 (0.54) | PTPN1CA2CA4CA5AALDH1A1 | |
| Tert-Butylbenzene SCHEMBL27361324 | 0.56 | PTPN1 (0.54) | PTPN1CA2CA4CA5AALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6107561-A | A PHOTOVOLTAIC CELL COMPRISING REDOX SYSTEMS FOR PRODUCTION OF HYDROGEN PEROXIDE FROM OXYGEN AND HYDROGEN GASES, THE PRODUCTION OF HYDROGEN GAS FROM WATER, AND THE REDUCTION OF KETONES TO FORM ALCOHOLS | UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 2000-08-22 | — | — | US | disclosed |
| US-5906892-A | GROUP VIII METAL COMPLEX ON SUPPORT | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 1999-05-25 | — | — | US | disclosed |
| US-5695890-A | PHOTOELECTRODE COMPRISING CHARGE TRANSFER COMPLEX; REDOX CATALYSTS | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 1997-12-09 | — | — | US | disclosed |
| US-5500297-A | PHOTOINDUCED CHARGE SEPARATION, ORGANIC PILLARS, REPEATING CATIONIC CENTERS AND METAL PHOSPHONATES WITH ENTRAPPED COLLOIDAL PARTICLES OF PALLADIUM OR PLATINUM | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 1996-03-19 | — | — | US | disclosed |