Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.51 |
| ▸ | CPA3 | P15088 | 3/20 | 0.50 |
| ▸ | LAP3 | P28838 | 3/20 | 0.49 |
| ▸ | ERAP2 | Q6P179 | 2/20 | 0.49 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.49 |
| ▸ | ANPEP | P15144 | 1/20 | 0.49 |
| ▸ | CPA1 | P15085 | 2/20 | 0.48 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.48 |
| ▸ | CPB1 | P15086 | 1/20 | 0.48 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16898112 | 1.00 | CYP1A2 (0.55) | CYP1A2GRIK1CPA3LAP3ERAP2 | |
| SCHEMBL16898110 | 1.00 | CYP1A2 (0.55) | CYP1A2GRIK1CPA3LAP3ERAP2 | |
| SCHEMBL1857365 | 0.90 | CYP1A2 (0.61) | CYP1A2GRIK1CPA3LAP3ERAP2 | |
| SCHEMBL18241165 | 0.89 | GRIK1 (0.66) | CYP1A2GRIK1CPA3CPA1FOLH1 | |
| SCHEMBL18241164 | 0.89 | GRIK1 (0.66) | CYP1A2GRIK1CPA3CPA1FOLH1 | |
| SCHEMBL7439191 | 0.88 | GRIK1 (0.64) | CYP1A2GRIK1CPA3LAP3ERAP2 | |
| SCHEMBL7439193 | 0.88 | GRIK1 (0.64) | CYP1A2GRIK1CPA3LAP3ERAP2 | |
| Water SCHEMBL4010621 | 0.88 | CYP1A2 (0.59) | CYP1A2GRIK1CPA3LAP3ERAP2 | |
| SCHEMBL7439419 | 0.88 | GRIK1 (0.64) | CYP1A2GRIK1CPA3LAP3ERAP2 | |
| SCHEMBL3272788 | 0.86 | CYP1A2 (0.53) | CYP1A2GRIK1CPA3LAP3ERAP2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100537522-C | Intermediate compound for preparing dextro cadotril and its preparation process and use | SHANGHAI INST OF MEDICINE INDU (CN) | 2009-09-09 | — | — | CN | claimed |
| CN-1931830-A | Intermediate compound for preparing dextro cadotril and its prepn process and use | SHANGHAI INST OF MEDICINE INDU (CN) | 2007-03-21 | — | — | CN | claimed |
| CN-100537522-C | Intermediate compound for preparing dextro cadotril and its preparation process and use | SHANGHAI INST OF MEDICINE INDU (CN) | 2009-09-09 | — | — | CN | disclosed |
| CN-1931830-A | Intermediate compound for preparing dextro cadotril and its prepn process and use | SHANGHAI INST OF MEDICINE INDU (CN) | 2007-03-21 | — | — | CN | disclosed |