Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 2/20 | 0.33 |
| ▸ | DPP4 | P27487 | 3/20 | 0.32 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.31 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.31 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | EEF2K | O00418 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL743074 | 0.80 | DPP4 (0.39) | FFAR1DPP4SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL743043 | 0.80 | DPP4 (0.39) | FFAR1DPP4SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL12971465 | 0.80 | DPP4 (0.39) | FFAR1DPP4SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL744345 | 0.80 | DPP4 (0.39) | FFAR1DPP4SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL3795621 | 0.74 | DPP4 (0.34) | FFAR1DPP4CYP2C19 | |
| SCHEMBL28304220 | 0.73 | DPP4 (0.33) | FFAR1DPP4SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL28937621 | 0.72 | FFAR1 (0.33) | FFAR1DPP4SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL3453796 | 0.71 | DPP4 (0.37) | FFAR1DPP4 | |
| SCHEMBL28696572 | 0.70 | S1PR2 (0.38) | FFAR1DPP4CYP3A4 | |
| SCHEMBL5084398 | 0.69 | EIF4A3 (0.34) | SLC1A3SLC1A2SLC1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105254519-B | Synthesizing method of sitagliptin key intermediate | 常州吉恩药业有限公司 | 2017-05-17 | — | — | CN | disclosed |
| CN-105254519-B | Synthesizing method of sitagliptin key intermediate | 常州吉恩药业有限公司 | 2017-05-17 | — | — | CN | disclosed |
| CN-105254519-A | Synthesizing method of sitagliptin key intermediate | GENCHEM & GENPHARM CHANGZHOU CO LTD | 2016-01-20 | — | — | CN | disclosed |