Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | RAD52 | P43351 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | GAPDH | P04406 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | AGO2 | Q9UKV8 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | HTR1D | P28221 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 3/20 | 0.30 |
| ▸ | IGF1R | P08069 | 3/20 | 0.30 |
| ▸ | FLT4 | P35916 | 3/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21709087 | 0.78 | EGFR (0.42) | RECQLTDP1MAPTMAPK1HSD17B10 | |
| Hydrochloric Acid SCHEMBL21693918 | 0.77 | EGFR (0.43) | RECQLKMT2ATDP1BLMMAPT | |
| SCHEMBL21709095 | 0.76 | HTR1A (0.31) | RECQLMAPTHTR1DHTR2A | |
| SCHEMBL8758848 | 0.72 | HTR2A (0.55) | MEN1KMT2AMAPTHTR2A | |
| SCHEMBL21709094 | 0.71 | TAAR1 (0.32) | HTR2A | |
| SCHEMBL21708941 | 0.69 | ADRB2 (0.46) | MAPTADRB2HTR1DEGFRIGF1R | |
| SCHEMBL21709103 | 0.67 | HTR2C (0.57) | MEN1RECQLKMT2AMAPTHSD17B10 | |
| SCHEMBL14801810 | 0.66 | CHEK1 (0.37) | ADRB2HTR1DHTR2A | |
| SCHEMBL21708942 | 0.64 | SPR (0.42) | MEN1KMT2ABLMKDM4EMAPT | |
| SCHEMBL21708905 | 0.62 | HTR6 (0.39) | MEN1KMT2AMAPTHTR1DHTR2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020032080-A1 | COMPOUND, SALT OF COMPOUND, NEUROMODULATION AGENT, METHOD FOR EVALUATING NEUROMODULATION AGENT, METHOD FOR PRODUCING COMPOUND, AND METHOD FOR PRODUCING SALT OF COMPOUND | 学校法人慶應義塾 | 2020-02-13 | — | — | WO | disclosed |