Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 4/20 | 0.51 |
| ▸ | DPP4 | P27487 | 5/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | XIAP | P98170 | 2/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.33 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10793023 | 1.00 | ACE (0.51) | ACEDPP4CYP3A4TSHRTDP1 | |
| SCHEMBL10793019 | 1.00 | ACE (0.51) | ACEDPP4CYP3A4TSHRTDP1 | |
| SCHEMBL10896677 | 0.98 | ACE (0.50) | ACEDPP4CYP3A4TSHRTDP1 | |
| Hydrochloric Acid SCHEMBL10796239 | 0.98 | ACE (0.50) | ACEDPP4CYP3A4TSHRTDP1 | |
| Hydrochloric Acid SCHEMBL10796235 | 0.98 | ACE (0.50) | ACEDPP4CYP3A4TSHRTDP1 | |
| SCHEMBL10915073 | 0.98 | ACE (0.50) | ACEDPP4CYP3A4TSHRTDP1 | |
| SCHEMBL6560281 | 0.88 | DPP4 (0.60) | ACEDPP4CYP3A4TSHRTDP1 | |
| SCHEMBL4480343 | 0.88 | DPP4 (0.60) | ACEDPP4CYP3A4TSHRTDP1 | |
| SCHEMBL4490580 | 0.88 | DPP4 (0.60) | ACEDPP4CYP3A4TSHRTDP1 | |
| SCHEMBL6560280 | 0.88 | DPP4 (0.60) | ACEDPP4CYP3A4TSHRTDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0599444-B1 | Dual action inhibitors | SQUIBB & SONS INC (US) | 1998-01-28 | — | — | EP | disclosed |
| EP-0783002-A2 | Dual action inhibitors | E.R. SQUIBB & SONS, INC. (US) | 1997-07-09 | — | — | EP | disclosed |
| EP-0599444-A1 | Dual action inhibitors | E.R. SQUIBB & SONS, INC. (US) | 1994-06-01 | — | — | EP | disclosed |