Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F10 | P00742 | 2/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.34 |
| ▸ | FEN1 | P39748 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7972077 | 0.89 | ALOX5AP (0.35) | ALOX5APFEN1 | |
| SCHEMBL7928260 | 0.84 | KIF11 (0.38) | PTGS2POLBALDH1A1 | |
| SCHEMBL7959207 | 0.83 | ALDH1A1 (0.34) | ALOX5APFEN1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL7972215 | 0.82 | PTGS2 (0.34) | SLC6A4SLC6A3PTGS2SLC6A2POLB | |
| SCHEMBL7972310 | 0.80 | PTGS2 (0.37) | SLC6A4SLC6A3PTGS2SLC6A2ALDH1A1 | |
| SCHEMBL7934116 | 0.79 | CTSL (0.39) | POLBALDH1A1 | |
| SCHEMBL7934057 | 0.77 | SLC6A3 (0.40) | SLC6A4SLC6A3PTGS2ALDH1A1 | |
| SCHEMBL7975083 | 0.77 | CA12 (0.39) | POLBALDH1A1HTT | |
| SCHEMBL7959206 | 0.76 | POLB (0.34) | SLC6A4SLC6A3PTGS2SLC6A2POLB | |
| SCHEMBL7971878 | 0.76 | MCL1 (0.38) | POLB |
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-1140896-A1 | BENZOTHIEPIN-ANILIDE DERIVATIVES, THEIR PRODUCTION AND THEIR USE FOR ANTAGONIZING CCR-5 | Takeda Chemical Industries, Ltd. (JP) | 2001-10-10 | — | — | EP | disclosed |
| US-6235771-B1 | AIDS THERPAY | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-05-22 | — | — | US | disclosed |
| WO-2000037455-A1 | BENZOTHIEPIN-ANILIDE DERIVATIVES, THEIR PRODUCTION AND THEIR USE FOR ANTAGONIZING CCR-5 | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2000-06-29 | — | — | WO | disclosed |