Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30698099 | 1.00 | CA12 (0.46) | CA12CA14MEN1KMT2ACYP2C9 | |
| SCHEMBL30698111 | 1.00 | CA12 (0.46) | CA12CA14MEN1KMT2ACYP2C9 | |
| SCHEMBL30698083 | 1.00 | CA12 (0.46) | CA12CA14MEN1KMT2ACYP2C9 | |
| SCHEMBL5814139 | 0.86 | CA12 (0.54) | CA12CA14MEN1KMT2ACYP2C9 | |
| SCHEMBL5814134 | 0.86 | CA12 (0.54) | CA12CA14MEN1KMT2ACYP2C9 | |
| SCHEMBL30698078 | 0.85 | TSHR (0.35) | CA12CA14MEN1KMT2ACYP2C9 | |
| SCHEMBL30698077 | 0.85 | TSHR (0.35) | CA12CA14MEN1KMT2ACYP2C9 | |
| SCHEMBL30698088 | 0.84 | LMNA (0.40) | BIRC2ALDH1A1 | |
| SCHEMBL30698080 | 0.84 | LMNA (0.40) | BIRC2ALDH1A1 | |
| SCHEMBL30698107 | 0.82 | CTSS (0.40) | CA12CA14BIRC2CA7 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113831391-B | Dipeptide compound capable of exerting rapid antidepressant effect and application thereof | 南京医科大学 | 2023-10-13 | — | — | CN | disclosed |