Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 1/20 | 0.43 |
| ▸ | XDH | P47989 | 7/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.38 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31396624 | 1.00 | PTPN11 (0.43) | PTPN11XDHS1PR1S1PR5RORC | |
| SCHEMBL31396554 | 0.91 | PTPN11 (0.45) | PTPN11XDH | |
| SCHEMBL23248021 | 0.88 | PTPN11 (0.43) | PTPN11XDHS1PR1S1PR5RORC | |
| SCHEMBL15607356 | 0.87 | PTPN11 (0.42) | PTPN11XDHS1PR1TBK1 | |
| SCHEMBL15607353 | 0.83 | TBK1 (0.49) | TBK1 | |
| SCHEMBL15607501 | 0.83 | TBK1 (0.41) | PTPN11TBK1 | |
| SCHEMBL31396556 | 0.82 | PTPN11 (0.47) | PTPN11KCNH2 | |
| SCHEMBL15607458 | 0.82 | TBK1 (0.44) | PTPN11TBK1 | |
| SCHEMBL31396616 | 0.81 | PTPN11 (0.53) | PTPN11 | |
| SCHEMBL15554915 | 0.81 | PTPN11 (0.43) | PTPN11XDHTBK1KCNH2 |
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-2021074279-A1 | SPIRO-FUSED TRICYCLIC MAP4K1 INHIBITORS | BAYER AKTIENGESELLSCHAFT (DE) | 2021-04-22 | — | — | WO | disclosed |