Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 2/20 | 0.57 |
| ▸ | EGFR | P00533 | 5/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.50 |
| ▸ | QPCT | Q16769 | 1/20 | 0.47 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.45 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.45 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.41 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.41 |
| ▸ | FEN1 | P39748 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.39 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.38 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL27666934 | 1.00 | TDO2 (0.57) | TDO2EGFRESR2QPCTQPCTL | |
| SCHEMBL29940022 | 0.80 | TDO2 (0.63) | TDO2EGFRPIK3CAPIK3CDKDM4E | |
| SCHEMBL8641138 | 0.79 | EGFR (0.64) | TDO2EGFRPIK3CAPIK3CDKDM4E | |
| SCHEMBL21982453 | 0.78 | EGFR (0.57) | TDO2EGFRPIK3CAPIK3CDKDM4E | |
| SCHEMBL30568937 | 0.78 | TDO2 (0.53) | TDO2EGFRPIK3CAPIK3CDKDM4E | |
| SCHEMBL30716943 | 0.78 | TDO2 (0.53) | TDO2EGFRPIK3CAPIK3CDKDM4E | |
| SCHEMBL29940057 | 0.78 | BACE1 (0.53) | TDO2EGFRPIK3CAPIK3R1ALOX5AP | |
| SCHEMBL27600720 | 0.78 | ALDH1A1 (0.56) | ESR2QPCTQPCTLPIK3CAPIK3R1 | |
| SCHEMBL27666932 | 0.77 | ESR2 (0.54) | TDO2EGFRESR2PIK3CAPIK3CD | |
| SCHEMBL30717283 | 0.77 | TDO2 (0.52) | TDO2EGFRESR2PIK3CAPIK3CD |
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-112110918-B | Spiro substituted pyrimido cyclic compounds, process for their preparation and their use in medicine | 劲方医药科技(上海)有限公司 | 2023-08-22 | — | — | CN | disclosed |