Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.60 |
| ▸ | SRC | P12931 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 3/20 | 0.49 |
| ▸ | PPARA | Q07869 | 3/20 | 0.48 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.45 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | TTR | P02766 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8156820 | 0.85 | TSHR (0.71) | TSHRPPARGPPARAALDH1A1L3MBTL1 | |
| SCHEMBL8150945 | 0.85 | TSHR (0.71) | TSHRPPARGPPARAALDH1A1L3MBTL1 | |
| SCHEMBL25778887 | 0.84 | TSHR (0.69) | TSHRPPARGPPARAALDH1A1L3MBTL1 | |
| SCHEMBL7165687 | 0.83 | PPARA (0.55) | PPARGPPARAPTGDR2ALDH1A1LTB4R | |
| SCHEMBL20230373 | 0.82 | PPARG (0.68) | TSHRPPARGPPARAALDH1A1L3MBTL1 | |
| SCHEMBL1714794 | 0.82 | PTGDR2 (0.68) | TSHRSRCPTGDR2ALDH1A1L3MBTL1 | |
| SCHEMBL28066250 | 0.80 | TSHR (0.90) | TSHRPPARGPPARAALDH1A1L3MBTL1 | |
| SCHEMBL2556920 | 0.79 | SRC (0.45) | TSHRSRCPTGDR2ALDH1A1L3MBTL1 | |
| SCHEMBL764893 | 0.79 | TSHR (0.63) | TSHRPPARGPPARAALDH1A1L3MBTL1 | |
| SCHEMBL13103865 | 0.79 | TSHR (0.63) | TSHRPPARGPPARAALDH1A1L3MBTL1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6214879-B1 | Allosteric inhibitors of pyruvate kinase | VIRGINIA COMMONWEALTH UNIVERSITY | 2001-04-10 | — | — | US | claimed |
| WO-1999048490-A1 | ALLOSTERIC INHIBITORS AND ACTIVATORS OF PYRUVATE KINASE | ALLOS THERAPEUTICS, INC. (US) | 1999-09-30 | — | — | WO | claimed |
| US-6534501-B2 | Allosteric inhibitors of pyruvate kinase | ALLOS THERAPEUTICS, INC. | 2003-03-18 | — | — | US | disclosed |
| US-20010046997-A1 | Allosteric inhibitors of pyruvate kinase | ALLOS THERAPEUTICS, INC. | 2001-11-29 | — | — | US | disclosed |
| US-6214879-B1 | Allosteric inhibitors of pyruvate kinase | VIRGINIA COMMONWEALTH UNIVERSITY | 2001-04-10 | — | — | US | disclosed |
| WO-1999048490-A1 | ALLOSTERIC INHIBITORS AND ACTIVATORS OF PYRUVATE KINASE | ALLOS THERAPEUTICS, INC. (US) | 1999-09-30 | — | — | WO | disclosed |