Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MGLL | Q99685 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28040661 | 0.86 | ACHE (0.36) | TSHRCYP2D6CYP2C19MGLL | |
| SCHEMBL4990523 | 0.84 | TSHR (0.49) | TSHR | |
| SCHEMBL11063649 | 0.84 | FAAH (0.42) | TSHRMGLL | |
| SCHEMBL7035394 | 0.81 | TSHR (0.36) | TSHR | |
| SCHEMBL8853273 | 0.81 | MIF (0.33) | TSHR | |
| SCHEMBL28101958 | 0.80 | — | — | |
| SCHEMBL28790908 | 0.79 | TSHR (0.38) | TSHR | |
| SCHEMBL28072506 | 0.78 | TSHR (0.51) | TSHR | |
| SCHEMBL27355205 | 0.76 | TSHR (0.34) | TSHR | |
| SCHEMBL2477920 | 0.75 | GABRP (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-107922773-A | Water-based ink for use in ink-jet recording | 花王株式会社 | 2018-04-17 | — | — | CN | disclosed |
| CN-105255348-A | One-component transparent waterborne polyurethane emulsion waterproof paint and preparation method thereof | UNIV XIAMEN | 2016-01-20 | — | — | CN | disclosed |