Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 3/20 | 0.42 |
| ▸ | PI4KA | P42356 | 3/20 | 0.42 |
| ▸ | PI4KB | Q9UBF8 | 3/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.42 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.42 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.42 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.33 |
| ▸ | FEN1 | P39748 | 2/20 | 0.33 |
| ▸ | AXL | P30530 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | IKBKB | O14920 | 1/20 | 0.33 |
| ▸ | DHPS | P49366 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 6/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL19783052 | 0.83 | ACACB (0.32) | CA1CA2CA4ACACB | |
| SCHEMBL21379557 | 0.80 | ACACB (0.39) | PIK3CAPI4KAPI4KBPIK3CDPIK3CB | |
| SCHEMBL30189840 | 0.80 | ACACB (0.39) | PIK3CAPI4KAPI4KBPIK3CDPIK3CB | |
| SCHEMBL21379555 | 0.80 | ACACB (0.39) | PIK3CAPI4KAPI4KBPIK3CDPIK3CB | |
| SCHEMBL19782789 | 0.77 | CYP3A4 (0.41) | PIK3CAPI4KAPI4KBPIK3CDPIK3CB | |
| SCHEMBL19782765 | 0.77 | ALOX5AP (0.37) | PIK3CAPI4KAPI4KBPIK3CDPIK3CB | |
| SCHEMBL19783197 | 0.77 | ACACB (0.34) | ACACB | |
| SCHEMBL19783056 | 0.73 | GAA (0.42) | PIK3CAPI4KAPI4KBPIK3CDPIK3CB | |
| SCHEMBL19782762 | 0.72 | ACACB (0.33) | PIK3CAPI4KAPI4KBPIK3CDPIK3CB | |
| SCHEMBL30189518 | 0.72 | ACACB (0.33) | PIK3CAPI4KAPI4KBPIK3CDPIK3CB |
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-2018013774-A1 | BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-01-18 | — | — | WO | disclosed |