Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | XBP1 | P17861 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 3/20 | 0.34 |
| ▸ | MMP3 | P08254 | 2/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP7 | P09237 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | CCR8 | P51685 | 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 | |
|---|---|---|---|---|
| SCHEMBL3111395 | 1.00 | CA2 (0.37) | CA2CA1CA4CA7CA9 | |
| SCHEMBL3126095 | 0.89 | TSHR (0.35) | CA2CA1CA4CA7CA9 | |
| SCHEMBL501931 | 0.83 | MMP13 (0.41) | MMP13KMT2AMEN1HTR6ALDH1A1 | |
| SCHEMBL7513515 | 0.77 | MMP13 (0.40) | MMP13KMT2AMEN1HTR6ALDH1A1 | |
| SCHEMBL2288800 | 0.75 | CA2 (0.44) | CA2CA1CA4CA7CA9 | |
| SCHEMBL7405969 | 0.71 | MMP13 (0.39) | MMP13KMT2AMEN1HTR6ALDH1A1 | |
| SCHEMBL7405973 | 0.71 | MMP13 (0.39) | MMP13KMT2AMEN1HTR6ALDH1A1 | |
| SCHEMBL7409438 | 0.71 | MMP13 (0.39) | MMP13KMT2AMEN1HTR6ALDH1A1 | |
| SCHEMBL5930698 | 0.71 | ALDH1A1 (0.46) | CA2CA1CA4CA7CA9 | |
| SCHEMBL10771357 | 0.70 | ALDH1A1 (0.45) | CA2CA1CA4CA7CA9 |
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-2038041-A2 | THERAPEUTIC COMPOUNDS AND THEIR USE IN CANCER | Myriad Genetics, Inc. (US) | 2009-03-25 | — | — | EP | disclosed |
| WO-2007134298-A2 | THERAPEUTIC COMPOUNDS AND THEIR USE IN CANCER | MYRIAD GENETICS, INC. (US) | 2007-11-22 | — | — | WO | disclosed |