Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SSTR4 | P31391 | 4/20 | 0.39 |
| ▸ | CNR2 | P34972 | 4/20 | 0.38 |
| ▸ | CNR1 | P21554 | 3/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 3/20 | 0.34 |
| ▸ | ADAM17 | P78536 | 3/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6826385 | 0.81 | SIGMAR1 (0.43) | CNR2CNR1ALDH1A1KDM4EGAA | |
| SCHEMBL7065633 | 0.78 | SIGMAR1 (0.45) | ALDH1A1KDM4E | |
| SCHEMBL6820957 | 0.78 | ALDH1A1 (0.46) | CNR2CNR1ALDH1A1GAA | |
| SCHEMBL6825996 | 0.77 | CHRM2 (0.42) | ALDH1A1 | |
| SCHEMBL6825947 | 0.72 | MMP1 (0.35) | FFAR1CYP2C9NAMPTMMP1ADAM17 | |
| SCHEMBL11811154 | 0.68 | FFAR1 (0.41) | FFAR1CYP2C9NAMPTP2RX7KDM4E | |
| Hydrochloric Acid SCHEMBL6819993 | 0.67 | SMN1; SMN2 (0.35) | ALDH1A1MMP1MMP13KDM4E | |
| SCHEMBL6820894 | 0.67 | KMT2A (0.52) | ALDH1A1GAA | |
| SCHEMBL8709467 | 0.65 | NPC1 (0.39) | ALDH1A1MMP1MMP13GAA | |
| SCHEMBL6819903 | 0.65 | SMN1; SMN2 (0.37) | ALDH1A1MMP1MMP13KDM4EGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004099185-A1 | 2-CYANOPYRROLIDINE DERIVATIVES AND THEIR USE AS DPP-IV INHIBITORS | FUJISAWA PHARMACEUTICAL CO. LTD. (JP) | 2004-11-18 | — | — | WO | disclosed |