Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.50 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | MIF | P14174 | 1/20 | 0.42 |
| ▸ | NTRK1 | P04629 | 8/20 | 0.41 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.41 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.41 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL26947314 | 0.85 | CYP19A1 (0.55) | CYP19A1HRH4HRH3MIFNTRK1 | |
| SCHEMBL25217051 | 0.82 | CYP19A1 (0.58) | CYP19A1HRH4HRH3MIFGPR88 | |
| SCHEMBL21016237 | 0.76 | CYP19A1 (0.60) | CYP19A1HRH4HRH3MIFGPR88 | |
| SCHEMBL12985206 | 0.74 | EPHX2 (0.50) | CYP19A1HRH4HRH3MIFNTRK1 | |
| SCHEMBL23573912 | 0.74 | NTRK1 (0.39) | CYP19A1HRH4HRH3NTRK1KCNJ6 | |
| SCHEMBL19535293 | 0.74 | CYP19A1 (0.58) | CYP19A1HRH4HRH3MIFIDO1 | |
| SCHEMBL9091212 | 0.73 | CYP19A1 (0.57) | CYP19A1HRH4HRH3MIFGPR88 | |
| SCHEMBL12985578 | 0.73 | SMYD3 (0.50) | CYP19A1HRH4HRH3MIFNTRK1 | |
| SCHEMBL21016441 | 0.73 | CYP19A1 (0.45) | CYP19A1HRH4HRH3MIFIDO1 | |
| SCHEMBL21984860 | 0.72 | NTRK1 (0.41) | NTRK1 |
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-2023239906-A2 | SIALIC ACID DERIVATIVES AND METHODS OF USING SAME | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2023-12-14 | — | — | WO | disclosed |