Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTBK1 | Q5TCY1 | 1/20 | 0.58 |
| ▸ | TTBK2 | Q6IQ55 | 1/20 | 0.58 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.57 |
| ▸ | CDK1 | P06493 | 2/20 | 0.57 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.57 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.57 |
| ▸ | EGFR | P00533 | 12/20 | 0.57 |
| ▸ | FADS1 | O60427 | 3/20 | 0.57 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.57 |
| ▸ | LCK | P06239 | 1/20 | 0.56 |
| ▸ | ABL1 | P00519 | 4/20 | 0.54 |
| ▸ | ABL2 | P42684 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL26618774 | 1.00 | TTBK1 (0.58) | TTBK1TTBK2CCNB2CDK1CCNB1 | |
| SCHEMBL26618910 | 0.79 | EGFR (0.59) | EGFRERBB2MAPTPDGFRBFBP1 | |
| SCHEMBL30683235 | 0.79 | EGFR (0.59) | EGFRERBB2MAPTPDGFRBFBP1 | |
| SCHEMBL4913660 | 0.79 | TTBK1 (0.63) | TTBK1TTBK2CCNB2CDK1CCNB1 | |
| SCHEMBL8319107 | 0.78 | EGFR (0.60) | CCNB2CDK1CCNB1CCNB3EGFR | |
| Hydrochloric Acid SCHEMBL7537154 | 0.78 | TTBK1 (0.61) | TTBK1TTBK2CCNB2CDK1CCNB1 | |
| SCHEMBL26618850 | 0.78 | EGFR (0.60) | EGFRMEN1MAPTKMT2ANPC1 | |
| SCHEMBL30683203 | 0.78 | EGFR (0.60) | EGFRMEN1MAPTKMT2ANPC1 | |
| SCHEMBL9017044 | 0.78 | EGFR (0.68) | TTBK1TTBK2CCNB2CDK1CCNB1 | |
| SCHEMBL3061494 | 0.77 | EGFR (0.62) | TTBK1TTBK2CDK1EGFRFADS1 |
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-2023209250-A1 | PYRIMIDO[5,4-D]PYRIMIDINE-BASED COMPOUNDS, METHODS AND USES THEREOF | UNIVERSIDADE DO MINHO (PT) | 2023-11-02 | — | — | WO | disclosed |