Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 4/20 | 0.52 |
| ▸ | PRMT3 | O60678 | 2/20 | 0.49 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.41 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.41 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.41 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.38 |
| ▸ | CLK1 | P49759 | 1/20 | 0.38 |
| ▸ | CLK2 | P49760 | 1/20 | 0.38 |
| ▸ | CLK3 | P49761 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL26107591 | 1.00 | CYP17A1 (0.52) | CYP17A1PRMT3NAMPTSYKBRAF | |
| SCHEMBL25859564 | 0.84 | CLK1 (0.41) | CYP17A1NAMPTRAB9ACLK1CLK2 | |
| SCHEMBL16307603 | 0.81 | CYP17A1 (0.55) | CYP17A1NAMPTSYKACVR1BTGFBR1 | |
| SCHEMBL15039524 | 0.81 | CYP17A1 (0.55) | CYP17A1NAMPTSYKACVR1BTGFBR1 | |
| SCHEMBL30627587 | 0.77 | NQO2 (0.47) | PRMT3NAMPTACVR1BTGFBR1ACVRL1 | |
| SCHEMBL30627557 | 0.77 | NQO2 (0.47) | PRMT3NAMPTACVR1BTGFBR1ACVRL1 | |
| SCHEMBL30381667 | 0.76 | DYRK1A (0.54) | CYP17A1NAMPTSYKRAB9ACLK2 | |
| SCHEMBL18522430 | 0.76 | NAMPT (0.50) | CYP17A1NAMPTRAB9ABRS3 | |
| SCHEMBL14725520 | 0.76 | CYP17A1 (0.48) | CYP17A1SYKBRAFAAK1 | |
| SCHEMBL5746021 | 0.75 | NAMPT (0.47) | CYP17A1NAMPTRAB9AAAK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4504730-A1 | DISCOVERY OF COVALENT EGFR INHIBITOR THROUGH CYSTEINE 775 | Dana-Farber Cancer Institute, Inc. (US) | 2025-02-12 | — | — | EP | disclosed |
| WO-2023196409-A1 | DISCOVERY OF COVALENT EGFR INHIBITOR THROUGH CYSTEINE 775 | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2023-10-12 | — | — | WO | disclosed |