Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.38 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TGM2 | P21980 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.33 |
| ▸ | ITGA5 | P08648 | 2/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.33 |
| ▸ | ITGAV | P06756 | 1/20 | 0.33 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9596597 | 0.93 | ABCB1 (0.42) | ABCB1DPP8DPP9ALDH1A1MAPT | |
| SCHEMBL9518902 | 0.90 | DPP8 (0.36) | ABCB1DPP8DPP9ALDH1A1MAPT | |
| SCHEMBL10390735 | 0.85 | ALDH1A1 (0.39) | ALDH1A1MAPTHPGDGAACCR5 | |
| SCHEMBL9596622 | 0.85 | DPP8 (0.40) | ABCB1DPP8DPP9ALDH1A1MAPT | |
| SCHEMBL10390658 | 0.85 | ALDH1A1 (0.38) | ALDH1A1MAPTHPGDCCR5TDP1 | |
| SCHEMBL9142600 | 0.84 | ABCB1 (0.48) | ABCB1DPP8DPP9ALDH1A1MAPT | |
| SCHEMBL10391502 | 0.84 | ALDH1A1 (0.38) | ABCB1ALDH1A1MAPTHPGDCCR5 | |
| SCHEMBL10390670 | 0.84 | GAA (0.45) | ABCB1DPP8DPP9ALDH1A1MAPT | |
| SCHEMBL10390672 | 0.84 | GAA (0.45) | ABCB1DPP8DPP9ALDH1A1MAPT | |
| SCHEMBL8923324 | 0.83 | ALDH1A1 (0.40) | ALDH1A1MAPTHPGDGAACCR5 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1993011128-A1 | AMINOALKYLPYRROLIDINYLTHIOCARBAPENEM DERIVATIVES | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1993-06-10 | — | — | WO | disclosed |