Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | BTK | Q06187 | 4/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4292808 | 0.84 | SLC6A3 (0.45) | UTS2R | |
| SCHEMBL4288935 | 0.83 | TSHR (0.39) | SMN1; SMN2TSHRMAPTHSD11B1 | |
| SCHEMBL4285848 | 0.82 | SLC6A2 (0.42) | POLBSMN1; SMN2BTKALDH1A1TSHR | |
| SCHEMBL4291623 | 0.81 | HCRTR2 (0.41) | POLBHPGDHSD11B1KDM4E | |
| SCHEMBL4280118 | 0.79 | HTR2A (0.40) | BTKHSD11B1 | |
| SCHEMBL4285491 | 0.79 | KMT2A (0.41) | SMN1; SMN2ALDH1A1SIGMAR1 | |
| SCHEMBL4282511 | 0.78 | HSD17B10 (0.46) | SMN1; SMN2HPGDALDH1A1TSHRGAA | |
| SCHEMBL4294072 | 0.77 | CHRNB4 (0.41) | POLBSMN1; SMN2ALDH1A1CHRNB4CHRNA3 | |
| SCHEMBL4291881 | 0.77 | SLC6A3 (0.40) | ALDH1A1MAPTHSD11B1CHRNB4CHRNA3 | |
| SCHEMBL4282253 | 0.72 | TACR1 (0.41) | — |
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-2009072643-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-06-11 | — | — | WO | disclosed |