Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.60 |
| ▸ | BRD4 | O60885 | 1/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | PTPN5 | P54829 | 4/20 | 0.44 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10789751 | 1.00 | PTGS2 (0.60) | PTGS2BRD4CYP11B2ADRA2AADRA1D | |
| Cyclohexane SCHEMBL9787037 | 0.98 | PTGS2 (0.63) | PTGS2BRD4CYP11B2ADRA2AADRA1D | |
| SCHEMBL28154893 | 0.98 | PTGS2 (0.63) | PTGS2BRD4CYP11B2ADRA2AADRA1D | |
| SCHEMBL30407966 | 0.98 | PTGS2 (0.63) | PTGS2BRD4CYP11B2ADRA2AADRA1D | |
| SCHEMBL60703 | 0.98 | PTGS2 (0.63) | PTGS2BRD4CYP11B2ADRA2AADRA1D | |
| Benzene SCHEMBL27912155 | 0.98 | PTGS2 (0.63) | PTGS2BRD4CYP11B2ADRA2AADRA1D | |
| Water SCHEMBL27498058 | 0.96 | PTGS2 (0.61) | PTGS2BRD4CYP11B2ADRA2AADRA1D | |
| Phosphine SCHEMBL27888972 | 0.96 | PTGS2 (0.61) | PTGS2BRD4CYP11B2ADRA2AADRA1D | |
| Hydrogen Sulfide SCHEMBL27800905 | 0.96 | PTGS2 (0.61) | PTGS2BRD4CYP11B2ADRA2AADRA1D | |
| SCHEMBL28228917 | 0.96 | PTGS2 (0.56) | PTGS2BRD4CYP11B2ADRA2AADRA1D |
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 |
|---|---|---|---|---|---|---|---|
| CN-118742545-A | Fused heterocyclic compounds as PI3K alpha inhibitors | 南京征祥医药有限公司 | 2024-10-01 | — | — | CN | disclosed |
| CN-114008025-A | ACSS2 inhibitors and methods of use thereof | 美特波米德有限公司 | 2022-02-01 | — | — | CN | disclosed |