Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | FLT3 | P36888 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.38 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.38 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 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 | |
|---|---|---|---|---|
| SCHEMBL23507263 | 0.76 | TSHR (0.56) | TSHRALDH1A1MAPK1KDM4ECALM1 | |
| SCHEMBL21554823 | 0.75 | ALDH1A1 (0.41) | TSHRALDH1A1KDM4EHSD17B10CALM1 | |
| SCHEMBL3100529 | 0.73 | ALDH1A1 (0.52) | TSHRALDH1A1MAPK1CALM1GAA | |
| SCHEMBL23507393 | 0.73 | GRIN2D (0.51) | TSHRALDH1A1MAPK1CALM1GRIN2D | |
| SCHEMBL14045705 | 0.71 | ALDH1A1 (0.52) | TSHRALDH1A1KDM4E | |
| SCHEMBL16327151 | 0.69 | PYCR1 (0.50) | — | |
| SCHEMBL15746871 | 0.69 | TSHR (0.47) | TSHRALDH1A1MAPK1HSD17B10CALM1 | |
| SCHEMBL17887960 | 0.68 | PYCR1 (0.51) | MEN1KMT2A | |
| SCHEMBL4267535 | 0.68 | CXCR3 (0.41) | TSHRALDH1A1 | |
| SCHEMBL1240985 | 0.68 | PYCR1 (0.51) | ALDH1A1KDM4E |
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-2776408-B1 | ANTICANCER BENZOPYRAZINES VIA THE INHIBITION OF FGFR KINASES | ASTEX THERAPEUTICS LTD (GB) | 2019-11-06 | — | — | EP | disclosed |