Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.50 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | DHODH | Q02127 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10689235 | 1.00 | NPSR1 (0.50) | NPSR1GLO1ALDH1A1SMN1; SMN2CYP2D6 | |
| SCHEMBL6887908 | 0.83 | NPSR1 (0.54) | NPSR1GLO1ALDH1A1SMN1; SMN2CYP2D6 | |
| SCHEMBL9298246 | 0.82 | NPSR1 (0.46) | NPSR1GLO1ALDH1A1SMN1; SMN2CYP2D6 | |
| SCHEMBL9298250 | 0.82 | NPSR1 (0.46) | NPSR1GLO1ALDH1A1SMN1; SMN2CYP2D6 | |
| SCHEMBL13269051 | 0.82 | NPSR1 (0.62) | NPSR1GLO1ALDH1A1SMN1; SMN2CYP2D6 | |
| SCHEMBL1942274 | 0.82 | NPSR1 (0.62) | NPSR1GLO1ALDH1A1SMN1; SMN2CYP2D6 | |
| SCHEMBL2601721 | 0.81 | CYP2C9 (0.49) | NPSR1GLO1ALDH1A1SMN1; SMN2CYP2D6 | |
| SCHEMBL28995580 | 0.81 | CYP2C9 (0.49) | NPSR1GLO1ALDH1A1SMN1; SMN2CYP2D6 | |
| SCHEMBL26047892 | 0.81 | CYP2C9 (0.49) | NPSR1GLO1ALDH1A1SMN1; SMN2CYP2D6 | |
| SCHEMBL1298514 | 0.80 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4782162-A | Novel intermediates for the synthesis of cephalosporins | BAYER AKTIENGESELLSCHAFT (DE) | 1988-11-01 | — | — | US | disclosed |
| US-4416880-A | β-Lactam antibiotics and compositions containing the same | BAYER AKTIENGESELLSCHAFT (DE) | 1983-11-22 | — | — | US | disclosed |