Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 2/20 | 0.42 |
| ▸ | MMP9 | P14780 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 8/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | PSEN1 | P49768 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3430638 | 1.00 | MMP2 (0.42) | MMP2MMP9CA12CA1CA2 | |
| SCHEMBL3935383 | 1.00 | MMP2 (0.42) | MMP2MMP9CA12CA1CA2 | |
| SCHEMBL4850159 | 1.00 | MMP2 (0.42) | MMP2MMP9CA12CA1CA2 | |
| SCHEMBL15259590 | 0.88 | TDP1 (0.40) | MMP2MMP9CA12CA1CA2 | |
| SCHEMBL5221662 | 0.85 | TSHR (0.41) | MMP2MMP9CA12CA1CA2 | |
| SCHEMBL5221657 | 0.85 | TSHR (0.41) | MMP2MMP9CA12CA1CA2 | |
| SCHEMBL14534604 | 0.85 | MMP2 (0.60) | MMP2MMP9CA12CA1CA2 | |
| SCHEMBL5221651 | 0.85 | TSHR (0.41) | MMP2MMP9CA12CA1CA2 | |
| SCHEMBL29933069 | 0.85 | TSHR (0.41) | MMP2MMP9CA12CA1CA2 | |
| SCHEMBL11818077 | 0.84 | MMP2 (0.36) | MMP2MMP9CA12CA1CA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0174572-B1 | CYCLOHEXANE-1,2-DICARBOXYLIC AMIDES, IONIC-SELECTIVES MEMBRANES AND TEST APPARATUS CONTAINING THESE COMPOUNDS | Willi Möller AG (CH) | 1991-03-06 | — | — | EP | claimed |
| EP-0174572-B1 | CYCLOHEXANE-1,2-DICARBOXYLIC AMIDES, IONIC-SELECTIVES MEMBRANES AND TEST APPARATUS CONTAINING THESE COMPOUNDS | Willi Möller AG (CH) | 1991-03-06 | — | — | EP | disclosed |