Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 6/20 | 0.43 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.31 |
| ▸ | GABBR1 | Q9UBS5 | 3/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | APEX1 | P27695 | 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 | |
|---|---|---|---|---|
| SCHEMBL11028401 | 1.00 | DPP4 (0.43) | DPP4GABRR1GABBR1CYP3A4TSHR | |
| SCHEMBL11027484 | 0.79 | DPP4 (0.42) | DPP4GABBR1CYP3A4TSHRTDP1 | |
| SCHEMBL11283424 | 0.79 | DPP4 (0.42) | DPP4GABBR1CYP3A4TSHRTDP1 | |
| SCHEMBL10369909 | 0.78 | DPP4 (0.45) | DPP4CYP3A4TSHRTDP1MAPT | |
| SCHEMBL11021978 | 0.78 | DPP4 (0.45) | DPP4CYP3A4TSHRTDP1MAPT | |
| SCHEMBL11030799 | 0.68 | DPP4 (0.34) | DPP4 | |
| SCHEMBL11030801 | 0.68 | DPP4 (0.34) | DPP4 | |
| SCHEMBL11030805 | 0.68 | DPP4 (0.34) | DPP4 | |
| SCHEMBL7445807 | 0.63 | — | — | |
| SCHEMBL7435357 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0061765-B1 | BETA-LACTAMS | E.R. SQUIBB & SONS, INC. (US) | 1985-08-28 | — | — | EP | disclosed |
| US-4478749-A | AMINO ACID DERTIVATIVES ANTIBIOTICS | E. R. SQUIBB & SONS, INC. (US) | 1984-10-23 | — | — | US | disclosed |