Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN10A | Q9Y5Y9 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | GAK | O14976 | 1/20 | 0.31 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.31 |
| ▸ | COQ8A | Q8NI60 | 1/20 | 0.31 |
| ▸ | NLK | Q9UBE8 | 1/20 | 0.31 |
| ▸ | RXRA | P19793 | 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 | |
|---|---|---|---|---|
| SCHEMBL7189386 | 0.79 | CYP1A2 (0.40) | MAPTCA1CA2CA9 | |
| SCHEMBL7189375 | 0.79 | CYP1A2 (0.40) | MAPTCA1CA2CA9 | |
| SCHEMBL12098518 | 0.79 | RXRA (0.46) | MAPTSMN1; SMN2ALDH1A1HPGDALOX15 | |
| SCHEMBL411850 | 0.77 | CA1 (0.36) | SCN10AMAPTCA1CA2CA9 | |
| SCHEMBL5204561 | 0.77 | CA1 (0.39) | MAPTCA1CA2CA9SMN1; SMN2 | |
| SCHEMBL8648687 | 0.75 | TUBB4A (0.39) | MAPTCA1CA2CA9ALDH1A1 | |
| SCHEMBL8113705 | 0.74 | KLF10 (0.39) | MAPTCA1CA2CA9ALDH1A1 | |
| SCHEMBL12098137 | 0.74 | CYP2C19 (0.33) | MAPTSMN1; SMN2ALDH1A1ALOX15HSD17B10 | |
| SCHEMBL4261446 | 0.73 | CA1 (0.31) | MAPTCA1CA2CA9SMN1; SMN2 | |
| SCHEMBL4261454 | 0.73 | CA1 (0.31) | MAPTCA1CA2CA9SMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0552309-A1 | NEW PROCESS FOR BIOPHOSPHORYLATING ORGANIC COMPOUNDS | MERCK & CO. INC. (US) | 1993-07-28 | — | — | EP | disclosed |
| WO-1992006992-A2 | NEW PROCESS FOR BIOPHOSPHORYLATING ORGANIC COMPOUNDS | MERCK & CO., INC. (US) | 1992-04-30 | — | — | WO | disclosed |
| EP-0434365-A2 | HIV protease inhibitors useful for the treatment of aids | MERCK & CO. INC. (US) | 1991-06-26 | — | — | EP | disclosed |