Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.41 |
| ▸ | CFTR | P13569 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | FDPS | P14324 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LAP3 | P28838 | 2/20 | 0.39 |
| ▸ | ANPEP | P15144 | 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 | |
|---|---|---|---|---|
| SCHEMBL11300130 | 0.84 | HPGD (0.54) | HPGDEPHX2TSHRTRPA1ALDH1A1 | |
| SCHEMBL17004009 | 0.82 | HPGD (0.58) | HPGDTSHRCFTRFDPSLAP3 | |
| SCHEMBL9972116 | 0.79 | HPGD (0.54) | HPGDEPHX2TSHRCALM1CFTR | |
| SCHEMBL388208 | 0.78 | HPGD (0.73) | HPGDEPHX2TSHRALDH1A1CALM1 | |
| SCHEMBL5247349 | 0.76 | HPGD (0.56) | HPGDEPHX2TSHRALDH1A1CALM1 | |
| SCHEMBL73500 | 0.74 | HPGD (0.54) | HPGDEPHX2TSHRCALM1FDPS | |
| SCHEMBL10424304 | 0.74 | HPGD (0.54) | HPGDEPHX2TSHRCALM1FDPS | |
| Benzylphosphonic Acid SCHEMBL44318 | 0.74 | HPGD (0.60) | HPGDTSHRLAP3ANPEP | |
| SCHEMBL8890450 | 0.74 | HPGD (0.54) | HPGDEPHX2TSHRCALM1FDPS | |
| SCHEMBL10424306 | 0.74 | HPGD (0.54) | HPGDEPHX2TSHRCALM1FDPS |
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-103382214-B | A kind of Tanshinone II A phosphoric acid phenol ester derivative and preparation method thereof | SHANGHAI LANGSA MEDICINE SCIENCE AND TECHNOLOGY CO., LTD. (CN) | 2016-03-02 | — | — | CN | disclosed |
| CN-103382214-A | Tanshinone IIA phosphate phenolic ester derivative and preparation process thereof | SHANGHAI LANGSA MEDICINE SCIENCE & TECHNOLOGY CO LTD | 2013-11-06 | — | — | CN | disclosed |