Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 1/20 | 0.41 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.35 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.35 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.35 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 5/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | KRAS | P01116 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23247021 | 0.88 | PTPN11 (0.38) | PTPN11HTR6GPR119NAMPTKRAS | |
| SCHEMBL23247795 | 0.88 | PTPN11 (0.34) | PTPN11USP30HTR6GPR119NAMPT | |
| SCHEMBL23246921 | 0.85 | PTPN11 (0.37) | PTPN11PIK3CA | |
| SCHEMBL23263335 | 0.80 | PTPN11 (0.38) | PTPN11L3MBTL1BRD4 | |
| SCHEMBL23246517 | 0.79 | SGK1 (0.47) | USP30SCD5 | |
| SCHEMBL23248027 | 0.78 | ACACB (0.38) | USP30SCD5PIK3CACYP11B2 | |
| SCHEMBL23263338 | 0.78 | PTPN11 (0.36) | PTPN11MMP2MMP13PIK3CARORC | |
| SCHEMBL23247375 | 0.78 | PTPN11 (0.36) | PTPN11MMP2MMP13PIK3CARORC | |
| SCHEMBL23247830 | 0.77 | USP30 (0.38) | USP30SCD5MMP2MMP13GPR119 | |
| SCHEMBL23246951 | 0.76 | USP30 (0.43) | USP30SCD5PIK3CACYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021074279-A1 | SPIRO-FUSED TRICYCLIC MAP4K1 INHIBITORS | BAYER AKTIENGESELLSCHAFT (DE) | 2021-04-22 | — | — | WO | disclosed |
| WO-2021074279-A1 | SPIRO-FUSED TRICYCLIC MAP4K1 INHIBITORS | BAYER AKTIENGESELLSCHAFT (DE) | 2021-04-22 | — | — | WO | disclosed |