Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 1/20 | 0.47 |
| ▸ | BDKRB1 | P46663 | 4/20 | 0.46 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22862672 | 1.00 | IDH1 (0.47) | IDH1BDKRB1CAMK2DTDP1KAT2B | |
| SCHEMBL29490304 | 0.86 | LDHA (0.47) | IDH1CAMK2DEGFRKDM4E | |
| SCHEMBL22862675 | 0.86 | LDHA (0.47) | IDH1CAMK2DEGFRKDM4E | |
| SCHEMBL17524366 | 0.81 | IDH1 (0.43) | IDH1BDKRB1CAMK2DKAT2BMAPT | |
| SCHEMBL29490302 | 0.80 | IDH1 (0.42) | IDH1BDKRB1MAPTRAB9AL3MBTL1 | |
| SCHEMBL22862580 | 0.80 | IDH1 (0.42) | IDH1BDKRB1MAPTRAB9AL3MBTL1 | |
| SCHEMBL20422607 | 0.80 | IDH1 (0.44) | IDH1BDKRB1CAMK2DKAT2BMAPT | |
| SCHEMBL18413317 | 0.80 | IDH1 (0.44) | IDH1BDKRB1CAMK2DKAT2BMAPT | |
| SCHEMBL17524386 | 0.79 | IDH1 (0.43) | IDH1BDKRB1CAMK2DKAT2BMAPT | |
| SCHEMBL22862696 | 0.78 | LDHA (0.41) | IDH1CAMK2DTDP1MAPTRAB9A |
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-3976009-A2 | BAX INHIBITORS AND USES THEREOF | Case Western Reserve University (US) | 2022-04-06 | — | — | EP | disclosed |