Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.45 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | FDPS | P14324 | 6/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | S1PR2 | O95136 | 4/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.32 |
| ▸ | S1PR4 | O95977 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28865008 | 0.98 | TSHR (0.44) | TSHRSMPD1HPGDFDPSTHRB | |
| SCHEMBL1081569 | 0.95 | SMPD1 (0.50) | TSHRSMPD1HPGDFDPSTHRB | |
| SCHEMBL28245086 | 0.94 | SMPD1 (0.53) | TSHRSMPD1HPGDFDPSS1PR2 | |
| Ammonia Solution, Strong SCHEMBL28245736 | 0.93 | SMPD1 (0.51) | TSHRSMPD1HPGDFDPSS1PR2 | |
| SCHEMBL6791410 | 0.91 | SMPD1 (0.56) | TSHRSMPD1HPGDFDPSTHRB | |
| SCHEMBL28245687 | 0.90 | TSHR (0.37) | TSHRSMPD1HPGDFDPSTHRB | |
| SCHEMBL6791402 | 0.89 | TSHR (0.46) | TSHRSMPD1HPGDFDPSTHRB | |
| Ammonia Solution, Strong SCHEMBL28245230 | 0.89 | TSHR (0.36) | TSHRSMPD1HPGDFDPSTHRB | |
| SCHEMBL28190023 | 0.88 | SMPD1 (0.46) | TSHRSMPD1HPGDFDPSS1PR2 | |
| SCHEMBL28117268 | 0.87 | SMPD1 (0.49) | TSHRSMPD1HPGDFDPSS1PR2 |
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-109803989-A | Optical stereo moulding composition | 可乐丽则武齿科株式会社 | 2019-05-24 | — | — | CN | disclosed |
| CN-105814092-B | Composition for hydrophilic cured product | 三井化学株式会社 | 2018-09-21 | — | — | CN | disclosed |