Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | DPP7 | Q9UHL4 | 4/20 | 0.35 |
| ▸ | DPP4 | P27487 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 5/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4123469 | 0.77 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2ADPP7DPP4 | |
| SCHEMBL27912479 | 0.77 | ALDH1A1 (0.46) | ALDH1A1MEN1KMT2ADPP7DPP4 | |
| SCHEMBL165002 | 0.75 | ALDH1A1 (0.48) | ALDH1A1MEN1KMT2ADPP7DPP4 | |
| SCHEMBL10665653 | 0.75 | ALDH1A1 (0.48) | ALDH1A1MEN1KMT2ADPP7DPP4 | |
| SCHEMBL2142203 | 0.75 | ALDH1A1 (0.46) | ALDH1A1MEN1KMT2ADPP7DPP4 | |
| SCHEMBL11837046 | 0.73 | ALDH1A1 (0.63) | ALDH1A1MEN1KMT2ADPP7DPP4 | |
| SCHEMBL11061943 | 0.71 | ALDH1A1 (0.61) | ALDH1A1MEN1KMT2ADPP7DPP4 | |
| SCHEMBL6263459 | 0.71 | ALDH1A1 (0.44) | ALDH1A1DPP7HPGDTSHRGAA | |
| SCHEMBL9160777 | 0.71 | ALDH1A1 (0.39) | ALDH1A1KMT2ADPP7DPP4LMNA | |
| SCHEMBL9160768 | 0.71 | ALDH1A1 (0.39) | ALDH1A1KMT2ADPP7DPP4LMNA |
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-103848770-A | Method for preparing midbody (2S)-N-chloracetyl-2-cyano tetrahydropyrrole of vildagliptin | CHENGDU NUOWEIER BIOLOG PHARMACEUTICAL CO LTD | 2014-06-11 | — | — | CN | disclosed |