Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 7/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | HPGD | P15428 | 4/20 | 0.49 |
| ▸ | CASP1 | P29466 | 3/20 | 0.49 |
| ▸ | CASP7 | P55210 | 3/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.49 |
| ▸ | BRD4 | O60885 | 4/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | CDK9 | P50750 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SALL4 | Q9UJQ4 | 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 | |
|---|---|---|---|---|
| SCHEMBL6645321 | 0.86 | GAA (0.55) | BRAFGAAKDM4EALDH1A1HPGD | |
| SCHEMBL16415660 | 0.76 | BRD4 (0.80) | GAAKDM4EALDH1A1HPGDCASP1 | |
| SCHEMBL10120170 | 0.74 | GAA (0.58) | BRAFGAAKDM4EALDH1A1HPGD | |
| SCHEMBL1965016 | 0.73 | KMT2A (0.44) | BRAFGAAKDM4EALDH1A1HSD17B10 | |
| SCHEMBL10048855 | 0.72 | GAA (0.55) | GAAKDM4EALDH1A1HPGDCASP1 | |
| SCHEMBL10120095 | 0.72 | GAA (0.53) | GAAKDM4EALDH1A1HPGDCASP1 | |
| SCHEMBL4716238 | 0.71 | MAPK1 (0.49) | GAAALDH1A1HSD17B10ALOX15MAPK1 | |
| Hydrochloric Acid SCHEMBL23291072 | 0.70 | BRAF (0.49) | BRAFGAAKDM4EALDH1A1HPGD | |
| SCHEMBL7975453 | 0.70 | KMT2A (0.59) | BRAFGAAKDM4EALDH1A1HPGD | |
| SCHEMBL6643397 | 0.69 | GAA (0.54) | BRAFGAAKDM4EALDH1A1HPGD |
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-1218382-B1 | BICYCLIC IMIDAZO-3-YL-AMINE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2004-01-28 | — | — | EP | claimed |