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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 4/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 1/20 | 0.34 |
| ▸ | PYCR1 | P32322 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5183493 | 0.97 | TAAR1 (0.42) | TAAR1HTR2ACYP2A6IDO1PYCR1 | |
| SCHEMBL3295159 | 0.89 | TAAR1 (0.37) | TAAR1HTR2ACYP2A6IDO1CYP11B1 | |
| Hydrochloric Acid SCHEMBL29232066 | 0.75 | LOXL2 (0.50) | TAAR1CYP2A6 | |
| Hydrochloric Acid SCHEMBL5371703 | 0.75 | CYP3A4 (0.48) | CYP19A1CYP11B1CYP11B2MAOB | |
| SCHEMBL1838255 | 0.72 | ALDH1A1 (0.50) | CYP19A1CYP11B1CYP11B2MAOB | |
| SCHEMBL3890376 | 0.72 | TAAR1 (0.42) | TAAR1HTR2ACYP2A6IDO1PYCR1 | |
| Fluoride SCHEMBL28080567 | 0.70 | CYP2A6 (0.47) | TAAR1HTR2ACYP2A6IDO1PYCR1 | |
| Bromide SCHEMBL9014959 | 0.69 | CALM1 (0.43) | TAAR1HTR2ACYP2A6IDO1MAOB | |
| SCHEMBL2517808 | 0.67 | — | — | |
| Fluoride SCHEMBL27921066 | 0.67 | CYP2A6 (0.89) | TAAR1HTR2ACYP2A6IDO1 |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1225205-B1 | Carbon black reacted with diazonium salts and products | CABOT CORP (US) | 2010-10-06 | — | — | EP | disclosed |
| EP-1942156-B1 | Carbon black reacted with diazonium salts and products | CABOT CORP (US) | 2010-04-14 | — | — | EP | disclosed |
| EP-1942156-A1 | Carbon black reacted with diazonium salts and products | Cabot Corporation (US) | 2008-07-09 | — | — | EP | disclosed |
| US-7294185-B2 | In absence of exterior applies electrical current; wear resistance | CABOT CORPORATION (US) | 2007-11-13 | — | — | US | disclosed |
| EP-0799281-B2 | CARBON BLACK REACTED WITH DIAZONIUM SALTS AND PRODUCTS | CABOT CORP (US) | 2006-03-29 | — | — | EP | disclosed |
| US-20050034629-A1 | In absence of exterior applies electrical current; wear resistance | BELMONT JAMES A (US) | 2005-02-17 | — | — | US | disclosed |
| US-6740151-B2 | IN THE ABSENCE OF AN EXTERNALLY APPLIED ELECTRIC CURRENT SUFFICIENT TO REDUCE THE DIAZONIUM SALT AND ATTACH AN ORGANIC GROUP; IMPROVED ABRASION RESISTANCE. | CABOT CORPORATION | 2004-05-25 | — | — | US | disclosed |
| US-20030095914-A1 | In the absence of an externally applied electric current sufficient to reduce the diazonium salt and attach an organic group; improved abrasion resistance. | BELMONT JAMES A (US) | 2003-05-22 | — | — | US | disclosed |
| EP-0960136-B1 | THE USE OF MODIFIED CARBON BLACK IN GAS-PHASE POLYMERIZATIONS | CABOT CORP (US) | 2003-04-16 | — | — | EP | disclosed |
| US-6494946-B1 | PROCESSES FOR PREPARING A CARBON BLACK PRODUCT HAVING AN ORGANIC GROUP ATTACHED TO THE CARBON BLACK. IN ONE PROCESS AT LEAST ONE DIAZONIUM SALT REACTS WITH A CARBON BLACK IN THE ABSENCE OF AN EXTERNALLY APPLIED ELECTRIC CURRENT SUFFICIENT | CABOT CORPORATION | 2002-12-17 | — | — | US | disclosed |
| EP-0799281-B1 | CARBON BLACK REACTED WITH DIAZONIUM SALTS AND PRODUCTS | CABOT CORP (US) | 2002-07-24 | — | — | EP | disclosed |
| EP-1225205-A2 | Carbon black reacted with diazonium salts and products | CABOT CORPORATION (US) | 2002-07-24 | — | — | EP | disclosed |
| US-6042643-A | AS PIGMENT TO COLOR PLASTICS, PAPER, TEXTILE, RUBBER, AQUEOUS INKS | CABOT CORPORATION (US) | 2000-03-28 | — | — | US | disclosed |
| EP-0960136-A1 | THE USE OF MODIFIED CARBON BLACK IN GAS-PHASE POLYMERIZATIONS | CABOT CORPORATION (US) | 1999-12-01 | — | — | EP | disclosed |
| US-5919855-A | SOLVENT-FREE; BULK POLYMERIZATION | CABOT CORPORATION (US) | 1999-07-06 | — | — | US | disclosed |
| US-5900029-A | COLORING FIBER OR TEXTILE | CABOT CORPORATION (US) | 1999-05-04 | — | — | US | disclosed |
| US-5851280-A | Reaction of carbon black with diazonium salts, resultant carbon black products and their uses | CABOT CORPORATION (US) | 1998-12-22 | — | — | US | disclosed |
| WO-1998034960-A1 | THE USE OF MODIFIED CARBON BLACK IN GAS-PHASE POLYMERIZATIONS | CABOT CORPORATION (US) | 1998-08-13 | — | — | WO | disclosed |
| EP-0799281-A1 | CARBON BLACK REACTED WITH DIAZONIUM SALTS AND PRODUCTS | CABOT CORPORATION (US) | 1997-10-08 | — | — | EP | disclosed |
| WO-1996018688-A1 | CARBON BLACK REACTED WITH DIAZONIUM SALTS AND PRODUCTS | CABOT CORPORATION (US) | 1996-06-20 | — | — | WO | disclosed |