Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 2/20 | 0.36 |
| ▸ | MMP2 | P08253 | 2/20 | 0.36 |
| ▸ | MMP3 | P08254 | 2/20 | 0.36 |
| ▸ | MMP7 | P09237 | 2/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6819993 | 0.80 | SMN1; SMN2 (0.35) | SMN1; SMN2MMP1MMP2MMP3MMP13 | |
| SCHEMBL14738749 | 0.72 | SMN1; SMN2 (0.35) | SMN1; SMN2 | |
| SCHEMBL14817813 | 0.72 | BTK (0.46) | SMN1; SMN2KMT2AALDH1A1BTKKDM1A | |
| SCHEMBL14849363 | 0.71 | MGLL (0.42) | KMT2AALDH1A1MEN1GAAEPHX1 | |
| SCHEMBL13865535 | 0.70 | CHRM2 (0.36) | CHRM2CHRM1 | |
| SCHEMBL6820957 | 0.69 | ALDH1A1 (0.46) | KMT2AALDH1A1MEN1GAAEPHX1 | |
| SCHEMBL22998960 | 0.67 | BTK (0.58) | KMT2ABTKKDM1AMAOBGAA | |
| SCHEMBL3708594 | 0.67 | BTK (0.58) | KMT2ABTKKDM1AMAOBGAA | |
| SCHEMBL3708596 | 0.67 | BTK (0.58) | KMT2ABTKKDM1AMAOBGAA | |
| SCHEMBL743138 | 0.67 | EPHX1 (0.36) | SMN1; SMN2MMP2KMT2AALDH1A1MEN1 |
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-2004048352-A2 | 2-CYANOPYRROLIDINES AND THEIR ANALOGUES AS DPP-IV INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-06-10 | — | — | WO | disclosed |