Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 2/20 | 0.34 |
| ▸ | HTR7 | P34969 | 2/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.32 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.32 |
| ▸ | CCR4 | P51679 | 1/20 | 0.32 |
| ▸ | PLK1 | P53350 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | FLT3 | P36888 | 1/20 | 0.31 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1774897 | 0.86 | GAA (0.42) | ESR1GRM5GAATDP1NR4A2 | |
| SCHEMBL20685774 | 0.85 | MAPK14 (0.42) | ESR1GRM5NR4A2PLK1MAPK14 | |
| SCHEMBL5756104 | 0.83 | GRM5 (0.36) | ESR1GRM5HTR7JAK2JAK3 | |
| SCHEMBL20612065 | 0.80 | HCAR3 (0.43) | ESR1TDP1ALDH1A1SMN1; SMN2CCR4 | |
| SCHEMBL11306797 | 0.80 | CCR4 (0.34) | ESR1GRM5HTR7JAK2JAK3 | |
| SCHEMBL28277650 | 0.80 | HCAR3 (0.43) | ESR1TDP1ALDH1A1SMN1; SMN2CCR4 | |
| SCHEMBL20956373 | 0.79 | CCR4 (0.36) | ESR1GRM5HTR7CCR4 | |
| SCHEMBL28937980 | 0.78 | CRHR1 (0.42) | ESR1CCR4CCNA2CDK2 | |
| SCHEMBL29607425 | 0.78 | CRHR1 (0.42) | ESR1CCR4CCNA2CDK2 | |
| SCHEMBL20911283 | 0.78 | NR4A2 (0.34) | ESR1GRM5JAK2JAK3NR4A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3194383-B1 | QUINOLINONE PYRIMIDINES COMPOSITIONS AS MUTANT-ISOCITRATE DEHYDROGENASE INHIBITORS | FORMA THERAPEUTICS INC (US) | 2019-11-06 | — | — | EP | disclosed |