Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CTSA | P10619 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | TDO2 | P48775 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | SI | P14410 | 1/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.36 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5856096 | 0.89 | SRC (0.58) | SRCALDH1A1CTSAIDO1TDO2 | |
| SCHEMBL11215799 | 0.84 | PARP1 (0.48) | SRCALDH1A1CTSAIDO1TDO2 | |
| SCHEMBL11215583 | 0.80 | KYNU (0.49) | SRCALDH1A1GAACYP2D6 | |
| SCHEMBL11217162 | 0.80 | PARP1 (0.40) | ALDH1A1CTSAIDO1TDO2PARP1 | |
| SCHEMBL11520442 | 0.80 | IDO1 (0.48) | ALDH1A1CTSAIDO1TDO2S1PR4 | |
| SCHEMBL20930558 | 0.79 | CYP2D6 (0.60) | SRCALDH1A1CTSAIDO1TDO2 | |
| SCHEMBL8127110 | 0.78 | SRC (0.73) | SRCALDH1A1GAACYP2D6 | |
| SCHEMBL11217020 | 0.78 | GLS (0.44) | ALDH1A1CTSAIDO1TDO2PARP1 | |
| SCHEMBL9298735 | 0.77 | CES2 (0.48) | SRCALDH1A1CTSAIDO1TDO2 | |
| SCHEMBL536897 | 0.77 | CES2 (0.48) | SRCALDH1A1CTSAIDO1TDO2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4329454-A | Cephalosporin compounds | ELI LILLY AND COMPANY (US) | 1982-05-11 | — | — | US | disclosed |