Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 1/20 | 0.43 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.40 |
| ▸ | BTK | Q06187 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 7/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1984412 | 0.81 | IDH1 (0.44) | IDH1TGFBR1BTKAPPNFE2L2 | |
| SCHEMBL9000609 | 0.80 | TGFBR1 (0.44) | IDH1TGFBR1APPNFE2L2KDM4E | |
| SCHEMBL22578205 | 0.80 | IDH1 (0.41) | IDH1TGFBR1BTKAPPNFE2L2 | |
| SCHEMBL22578203 | 0.80 | IDH1 (0.41) | IDH1TGFBR1BTKAPPNFE2L2 | |
| SCHEMBL3081313 | 0.79 | IDH1 (0.47) | IDH1TGFBR1BTKAPPNFE2L2 | |
| SCHEMBL931475 | 0.79 | IDH1 (0.43) | IDH1TGFBR1BTKAPPEGFR | |
| SCHEMBL31621100 | 0.79 | IDH1 (0.43) | IDH1TGFBR1BTKAPPEGFR | |
| SCHEMBL506568 | 0.79 | IDH1 (0.47) | IDH1TGFBR1BTKNFE2L2ALDH1A1 | |
| SCHEMBL18901393 | 0.79 | IDH1 (0.43) | IDH1TGFBR1BTKAPPNFE2L2 | |
| SCHEMBL29432664 | 0.79 | IDH1 (0.47) | IDH1TGFBR1BTKNFE2L2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109843891-A | Oxadiazolopyridine derivatives as ghrelin O-acyltransferase (GOAT) inhibitors | 勃林格殷格翰国际有限公司 | 2019-06-04 | — | — | CN | disclosed |