Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Dichloroacetic 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 | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | RBP4 | P02753 | 1/20 | 0.31 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.31 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.31 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.31 |
| ▸ | RXRA | P19793 | 1/20 | 0.30 |
| ▸ | RXRB | P28702 | 1/20 | 0.30 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1285882 | 0.82 | CA2 (0.46) | CA2ALDH1A1GABRA1GABRB2NPSR1 | |
| SCHEMBL29688753 | 0.82 | CA2 (0.46) | CA2ALDH1A1GABRA1GABRB2NPSR1 | |
| Malonic Acid SCHEMBL29009140 | 0.82 | RBP4 (0.40) | CA2ALDH1A1GABRA1GABRB2NPSR1 | |
| Hydrochloric Acid SCHEMBL5073192 | 0.80 | CA2 (0.44) | CA2ALDH1A1GABRA1GABRB2NPSR1 | |
| SCHEMBL6544073 | 0.78 | CA2 (0.41) | CA2ALDH1A1GABRA1GABRB2NPSR1 | |
| Trifluoromethanesulfonic Acid SCHEMBL1286190 | 0.74 | CA2 (0.37) | CA2ALDH1A1GABRA1GABRB2TDP1 | |
| SCHEMBL5069666 | 0.73 | CA2 (0.36) | CA2ALDH1A1GABRA1GABRB2NPSR1 | |
| Methanesulfonic Acid Methyl Ester SCHEMBL5073212 | 0.72 | CA2 (0.34) | CA2ALDH1A1GABRA1GABRB2TSHR | |
| SCHEMBL20954016 | 0.71 | CA2 (0.41) | CA2ALDH1A1GABRA1GABRB2NPSR1 | |
| SCHEMBL7530383 | 0.70 | ALOX15 (0.46) | CA2ALDH1A1TDP1TSHRRXRA |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6083697-A | Chemical amplification for the synthesis of patterned arrays | AFFYMETRIX, INC. (US) | 2000-07-04 | — | — | US | claimed |
| US-20060141511-A1 | Chemical amplification for the synthesis of patterned arrays | AFFYMETRIX, INC (US) | 2006-06-29 | — | — | US | disclosed |
| US-7053198-B2 | Functionated photoacid generator and functionated polymer system for biological microarray synthesis | AFFYMETRIX, INC. (US) | 2006-05-30 | — | — | US | disclosed |
| US-20040203056-A1 | Chemical amplification for the synthesis of patterned arrays | AFFYMETRIX, INC. | 2004-10-14 | — | — | US | disclosed |
| US-6770436-B1 | RADIATION-ACTIVATED CATALYSTS (RACS), AUTOCATALYTIC REACTIONS, AND PROTECTIVE GROUPS ARE EMPLOYED TO ACHIEVE A HIGHLY SENSITIVE, HIGH RESOLUTION, RADIATION DIRECTED COMBINATORIAL SYNTHESIS OF PATTERN ARRAYS OF DIVERSE POLYMERS | AFFYMETRIX, INC. | 2004-08-03 | — | — | US | disclosed |
| US-20040109935-A1 | Functionated photoacid generator and functionated polymer system for biological microarray synthesis | AFFYMETRIX, INC. | 2004-06-10 | — | — | US | disclosed |
| US-20040110133-A1 | Functionated photoacid generator for biological microarray synthesis | AFFYMETRIX, INC. | 2004-06-10 | — | — | US | disclosed |
| EP-0946286-B1 | CHEMICAL AMPLIFICATION FOR THE SYNTHESIS OF PATTERNED ARRAYS | AFFYMETRIX INC (US) | 2003-03-19 | — | — | EP | disclosed |
| US-6083697-A | Chemical amplification for the synthesis of patterned arrays | AFFYMETRIX, INC. (US) | 2000-07-04 | — | — | US | disclosed |
| EP-0946286-A1 | CHEMICAL AMPLIFICATION FOR THE SYNTHESIS OF PATTERNED ARRAYS | Affymetrix, Inc. (a California Corporation) (US) | 1999-10-06 | — | — | EP | disclosed |
| WO-1998020967-A1 | CHEMICAL AMPLIFICATION FOR THE SYNTHESIS OF PATTERNED ARRAYS | AFFYMETRIX, INC. (US) | 1998-05-22 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20040203056-A1 | Chemical amplification for the synthesis of patterned arrays | PARG, RAD18, RAC2 | CA2 3070/4885ALDH1A1 1810/4885GABRA1 4049/4885 |
| US-20060141511-A1 | Chemical amplification for the synthesis of patterned arrays | PARG, RAD18, RAC2 | CA2 2852/4885ALDH1A1 1710/4885GABRA1 3993/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.