Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS2R38 | P59533 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TYR | P14679 | 1/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.40 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.40 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 5/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3802208 | 0.76 | TGM2 (0.52) | TAS2R38HSD17B10ALDH1A1TP53TSHR | |
| SCHEMBL3802207 | 0.76 | TGM2 (0.52) | TAS2R38HSD17B10ALDH1A1TP53TSHR | |
| SCHEMBL1743266 | 0.70 | HTR3E (0.61) | TAS2R38HSD17B10ALDH1A1TP53TSHR | |
| SCHEMBL14952315 | 0.70 | HTR3E (0.61) | TAS2R38HSD17B10ALDH1A1TP53TSHR | |
| SCHEMBL13358496 | 0.70 | HTR3E (0.61) | TAS2R38HSD17B10ALDH1A1TP53TSHR | |
| SCHEMBL3110483 | 0.68 | ALDH1A1 (0.54) | TAS2R38HSD17B10ALDH1A1TP53TSHR | |
| SCHEMBL11184467 | 0.65 | TAS2R38 (0.50) | TAS2R38HSD17B10ALDH1A1TP53TSHR | |
| SCHEMBL20627768 | 0.65 | MAPT (0.46) | TAS2R38HSD17B10ALDH1A1TP53TSHR | |
| SCHEMBL14962067 | 0.65 | MAPT (0.59) | TAS2R38HSD17B10ALDH1A1TP53TSHR | |
| SCHEMBL19233143 | 0.65 | F2 (0.45) | HSD17B10ALDH1A1TSHRLMNAKMT2A |
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-3019480-B1 | 2,4- OR 4,6-DIAMINOPYRIMIDINE COMPOUNDS AS IDH2 MUTANTS INHIBITORS FOR THE TREATMENT OF CANCER | AGIOS PHARMACEUTICALS INC (US) | 2020-05-06 | — | — | EP | disclosed |