Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA7 | P43166 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18177743 | 0.98 | GABRA1 (0.47) | GABRA1GABRB2TSHRKMT2ALMNA | |
| SCHEMBL27773642 | 0.81 | GABRA1 (0.43) | GABRA1GABRB2TSHRLMNAALDH1A1 | |
| SCHEMBL27901422 | 0.81 | ALDH1A1 (0.57) | GABRA1GABRB2TSHRKMT2ALMNA | |
| SCHEMBL21804754 | 0.81 | CA12 (0.43) | GABRA1GABRB2TSHRKMT2ALMNA | |
| SCHEMBL1345444 | 0.79 | GABRA1 (0.52) | GABRA1GABRB2TSHRKMT2ALMNA | |
| SCHEMBL31517035 | 0.79 | GABRA1 (0.52) | GABRA1GABRB2TSHRKMT2ALMNA | |
| SCHEMBL11476058 | 0.79 | KMT2A (0.46) | GABRA1GABRB2KMT2ALMNAALDH1A1 | |
| SCHEMBL9666407 | 0.79 | KMT2A (0.46) | TSHRKMT2AALDH1A1 | |
| SCHEMBL7443221 | 0.79 | POLB (0.47) | KMT2ALMNAALDH1A1CA1CA2 | |
| SCHEMBL6404524 | 0.79 | POLB (0.47) | KMT2ALMNAALDH1A1CA1CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6359172-B1 | Method of preparing 2- and 4-hydroxymandelic acid | GERARD KESSELS SOCIEDAD ANONIMA, S.A. (ES) | 2002-03-19 | — | — | US | disclosed |
| EP-0987245-B1 | A method of preparing 2- and 4-hydroxymandelic acid | GERARD KESSELS S A (ES) | 2002-03-13 | — | — | EP | disclosed |
| EP-0987245-A1 | A method of preparing 2- and 4-hydroxymandelic acid | Gerard Kessels S.A. (ES) | 2000-03-22 | — | — | EP | disclosed |