Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Acetic 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 | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.53 |
| ▸ | GABRR1 | P24046 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | THRB | P10828 | 2/20 | 0.53 |
| ▸ | BLM | P54132 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.53 |
| ▸ | GABBR2 | O75899 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | GABBR1 | Q9UBS5 | 2/20 | 0.53 |
| ▸ | GABRR3 | A8MPY1 | 1/20 | 0.53 |
| ▸ | GABRP | O00591 | 1/20 | 0.53 |
| ▸ | GABRD | O14764 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.53 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.53 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.53 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.53 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.53 |
| ▸ | GABRR2 | P28476 | 1/20 | 0.53 |
| ▸ | SLC6A1 | P30531 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL301894 | 1.00 | — | — | |
| Acetic Acid SCHEMBL9807766 | 1.00 | CYP1A2 (0.53) | CYP1A2GABRR1LMNATHRBBLM | |
| Acetic Acid SCHEMBL9116471 | 1.00 | CYP1A2 (0.53) | CYP1A2GABRR1LMNATHRBBLM | |
| Acetic Acid SCHEMBL707699 | 1.00 | CYP1A2 (0.53) | CYP1A2GABRR1LMNATHRBBLM | |
| Acetic Acid SCHEMBL10590830 | 0.97 | PAOX (0.50) | CYP1A2GABRR1LMNATHRBBLM | |
| Acetic Acid SCHEMBL10590828 | 0.97 | PAOX (0.50) | CYP1A2GABRR1LMNATHRBBLM | |
| Acetic Acid SCHEMBL29029757 | 0.97 | PAOX (0.50) | CYP1A2GABRR1LMNATHRBBLM | |
| Acetic Acid SCHEMBL9615722 | 0.97 | PAOX (0.50) | CYP1A2GABRR1LMNATHRBBLM | |
| Acetic Acid SCHEMBL28975705 | 0.97 | PAOX (0.50) | CYP1A2GABRR1LMNATHRBBLM | |
| Acetic Acid SCHEMBL7634596 | 0.97 | PAOX (0.50) | CYP1A2GABRR1LMNATHRBBLM |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10414666-B2 | Surface-modified cyanide-based transition metal compounds | NATRON ENERGY, INC. (US) | 2019-09-17 | — | — | US | claimed |
| EP-3331827-A1 | SURFACE-MODIFIED CYANIDE-BASED TRANSITION METAL COMPOUNDS | Natron Energy, Inc. (US) | 2018-06-13 | — | — | EP | claimed |
| US-20180105432-A1 | SURFACE-MODIFIED CYANIDE-BASED TRANSITION METAL COMPOUNDS | NATRON ENERGY, INC. (US) | 2018-04-19 | — | — | US | claimed |
| WO-2017004272-A1 | SURFACE-MODIFIED CYANIDE-BASED TRANSITION METAL COMPOUNDS | Alveo Energy, Inc. (US) | 2017-01-05 | — | — | WO | claimed |
| US-20160293932-A1 | SYNTHETIC METHODS FOR TRANSITION METAL COORDINATION COMPOUNDS | Alveo Energy, Inc. (US) | 2016-10-06 | — | — | US | claimed |
| US-9359219-B1 | Surface-modified cyanide-based transition metal compounds | Alveo Energy, Inc. (US) | 2016-06-07 | — | — | US | claimed |
| US-9299981-B1 | Surface-modified cyanide-based transition metal compounds | Alveo Energy, Inc. (US) | 2016-03-29 | — | — | US | claimed |
| US-9869027-B2 | Cleaning composition and method of manufacturing metal wiring using the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2018-01-16 | — | — | US | disclosed |
| US-20170029971-A1 | Process to deposit zinc-iron alloy layer material | ATOTECH DEUTSCHLAND GMBH (DE) | 2017-02-02 | — | — | US | disclosed |
| US-20160230289-A1 | CLEANING COMPOSITION AND METHOD OF MANUFACTURING METAL WIRING USING THE SAME | SAMSUNG DISPLAY CO LTD (KR) | 2016-08-11 | — | — | US | disclosed |
| US-9340759-B2 | Cleaning composition and method of manufacturing metal wiring using the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2016-05-17 | — | — | US | disclosed |
| EP-2675942-B1 | ALKALINE AQUEOUS ZINC-IRON ALLOY PLATING BATH AND METHOD USING THE SAME | ATOTECH DEUTSCHLAND GMBH (DE) | 2016-04-06 | — | — | EP | disclosed |
| US-20150136728-A1 | CLEANING COMPOSITION AND METHOD OF MANUFACTURING METAL WIRING USING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2015-05-21 | — | — | US | disclosed |
| US-20130316190-A1 | ZINC-IRON ALLOY LAYER MATERIAL | ATOTECH DEUTSCHLAND GMBH (DE) | 2013-11-28 | — | — | US | disclosed |
| EP-2489763-A1 | Zinc-iron alloy layer material | Atotech Deutschland GmbH (DE) | 2012-08-22 | — | — | EP | disclosed |
| US-20090305934-A1 | Polymers and their use for inhibition of scale build-up in automatic dishwashing applications | CREAMER MARIANNE P | 2009-12-10 | — | — | US | disclosed |
| EP-2130898-A1 | Polymers and Their Use for Inhibition of Scale Build-Up in Automatic Dishwashing Applications | Rohm and Haas Company (US) | 2009-12-09 | — | — | EP | disclosed |