Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A3 | P43003 | 1/20 | 0.50 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.50 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.50 |
| ▸ | MMP2 | P08253 | 4/20 | 0.49 |
| ▸ | MMP9 | P14780 | 4/20 | 0.49 |
| ▸ | CA1 | P00915 | 4/20 | 0.49 |
| ▸ | CA2 | P00918 | 4/20 | 0.49 |
| ▸ | MMP1 | P03956 | 3/20 | 0.49 |
| ▸ | MMP13 | P45452 | 3/20 | 0.49 |
| ▸ | MMP8 | P22894 | 3/20 | 0.49 |
| ▸ | MMP3 | P08254 | 2/20 | 0.44 |
| ▸ | MMP7 | P09237 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | MMP14 | P50281 | 2/20 | 0.43 |
| ▸ | TDO2 | P48775 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2216960 | 1.00 | SLC1A3 (0.50) | SLC1A3SLC1A2SLC1A1MMP2MMP9 | |
| SCHEMBL29831100 | 0.84 | CA2 (0.54) | SLC1A3SLC1A2SLC1A1MMP2MMP9 | |
| SCHEMBL7568069 | 0.84 | CA2 (0.54) | SLC1A3SLC1A2SLC1A1MMP2MMP9 | |
| SCHEMBL6321585 | 0.77 | TDO2 (0.61) | SLC1A3SLC1A2SLC1A1MMP2MMP9 | |
| SCHEMBL6321590 | 0.77 | TDO2 (0.61) | SLC1A3SLC1A2SLC1A1MMP2MMP9 | |
| SCHEMBL1287356 | 0.76 | CA1 (0.53) | SLC1A3SLC1A2SLC1A1MMP2MMP9 | |
| SCHEMBL7845236 | 0.76 | FFAR1 (0.44) | SLC1A3SLC1A2SLC1A1MMP2MMP9 | |
| SCHEMBL16005166 | 0.74 | MMP2 (0.61) | SLC1A3SLC1A2SLC1A1MMP2MMP9 | |
| SCHEMBL28042871 | 0.74 | MMP2 (0.61) | SLC1A3SLC1A2SLC1A1MMP2MMP9 | |
| SCHEMBL12169313 | 0.73 | CA2 (0.65) | SLC1A3SLC1A2SLC1A1MMP2MMP9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2346865-B1 | INDOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS | MERCK CANADA INC (CA) | 2015-07-15 | — | — | EP | disclosed |
| EP-2344497-A1 | AZAINDOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS | Merck Frosst Canada Ltd. (CA) | 2011-07-20 | — | — | EP | disclosed |
| WO-2010031183-A1 | INDOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS | MERCK FROSST CANADA LTD. (CA) | 2010-03-25 | — | — | WO | disclosed |
| WO-2010031184-A1 | AZAINDOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS | MERCK FROSST CANADA LTD. (CA) | 2010-03-25 | — | — | WO | disclosed |