Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 6/20 | 0.40 |
| ▸ | MMP8 | P22894 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.37 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 6/20 | 0.35 |
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | CA9 | Q16790 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MMP1 | P03956 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6816984 | 1.00 | MMP2 (0.40) | MMP2MMP8POLBEPHX2SMYD3 | |
| SCHEMBL8749658 | 0.81 | ATM (0.42) | MMP2MMP8EPHX2SMYD3EPHX1 | |
| SCHEMBL245467 | 0.81 | — | — | |
| SCHEMBL6658887 | 0.81 | EPHX2 (0.50) | MMP2MMP8POLBEPHX2EPHX1 | |
| SCHEMBL5263260 | 0.79 | EPHX1 (0.41) | MMP2MMP8POLBEPHX2SMYD3 | |
| SCHEMBL5263263 | 0.79 | EPHX1 (0.41) | MMP2MMP8POLBEPHX2SMYD3 | |
| SCHEMBL3229891 | 0.78 | EPHX2 (0.51) | MMP2MMP8POLBEPHX2SMYD3 | |
| SCHEMBL3229882 | 0.78 | EPHX2 (0.51) | MMP2MMP8POLBEPHX2SMYD3 | |
| SCHEMBL3539009 | 0.78 | EPHX2 (0.51) | MMP2MMP8POLBEPHX2SMYD3 | |
| Hydrochloric Acid SCHEMBL11416981 | 0.78 | — | — |
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 |