Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.37 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | DTYMK | P23919 | 2/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.36 |
| ▸ | PLK1 | P53350 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17338394 | 0.93 | CYP3A4 (0.40) | CYP3A4CYP3A5MAP4K4GPR119CXCR2 | |
| SCHEMBL17338168 | 0.85 | POLB (0.40) | CYP3A4CYP3A5MAP4K4GPR119POLB | |
| SCHEMBL17330621 | 0.82 | PIK3CD (0.41) | CYP3A4CYP3A5MAP4K4GPR119POLB | |
| SCHEMBL17330622 | 0.82 | PIK3CD (0.41) | CYP3A4CYP3A5MAP4K4GPR119POLB | |
| SCHEMBL17338397 | 0.80 | POLB (0.41) | CYP3A4CYP3A5POLBDTYMKPARP1 | |
| SCHEMBL17330726 | 0.79 | DPP4 (0.41) | CYP3A4CYP3A5MAP4K4GPR119TRPV3 | |
| SCHEMBL17330727 | 0.79 | DPP4 (0.41) | CYP3A4CYP3A5MAP4K4GPR119TRPV3 | |
| SCHEMBL17338192 | 0.79 | PIK3CD (0.49) | CYP3A4CYP3A5GPR119ACHE | |
| SCHEMBL17338201 | 0.79 | BACE1 (0.39) | GPR119KMT2ATRPV3 | |
| SCHEMBL17338241 | 0.78 | PIK3CD (0.49) | — |
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-3154958-A1 | PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS | Gilead Sciences, Inc. (US) | 2017-04-19 | — | — | EP | disclosed |
| WO-2015191752-A1 | PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS | GILEAD SCIENCES, INC. (US) | 2015-12-17 | — | — | WO | disclosed |