Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPSAB1 | Q15661 | 3/20 | 0.40 |
| ▸ | ABAT | P80404 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 4/20 | 0.39 |
| ▸ | F10 | P00742 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PLG | P00747 | 2/20 | 0.36 |
| ▸ | KLK1 | P06870 | 2/20 | 0.36 |
| ▸ | KLK6 | Q92876 | 2/20 | 0.36 |
| ▸ | BACE1 | P56817 | 2/20 | 0.35 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11845878 | 0.78 | ABAT (0.41) | TPSAB1ABATHDAC3HDAC6NCOR2 | |
| SCHEMBL11212104 | 0.75 | ESR1 (0.41) | KDM4E | |
| SCHEMBL11212846 | 0.74 | HDAC3 (0.44) | HDAC3HDAC6SMN1; SMN2 | |
| SCHEMBL11217364 | 0.74 | MAPT (0.41) | SMN1; SMN2 | |
| SCHEMBL11218294 | 0.74 | BRD4 (0.44) | — | |
| SCHEMBL11212918 | 0.74 | CYP1A2 (0.44) | SMN1; SMN2 | |
| SCHEMBL11210417 | 0.74 | CYP2C9 (0.42) | KDM4ESMN1; SMN2 | |
| SCHEMBL9781797 | 0.73 | SRC (0.46) | HDAC3HDAC6 | |
| SCHEMBL11210447 | 0.69 | CES2 (0.45) | HDAC3HDAC6SMN1; SMN2 | |
| Bicarbonate SCHEMBL31055587 | 0.69 | ABAT (0.60) | TPSAB1ABATHDAC3HDAC6NCOR2 |
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 |