Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 6/20 | 0.35 |
| ▸ | MAOB | P27338 | 6/20 | 0.35 |
| ▸ | KDM1A | O60341 | 4/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.35 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL876024 | 0.80 | CYP1A2 (0.48) | CYP1A2MAPTLMNACYP3A4TP53 | |
| SCHEMBL9257863 | 0.80 | CYP1A2 (0.41) | CYP1A2MAPTLMNACYP3A4TP53 | |
| SCHEMBL10424855 | 0.77 | MAOB (0.41) | CYP1A2MAPTLMNACYP3A4TP53 | |
| SCHEMBL9591661 | 0.75 | HTR2C (0.44) | LMNAMAPK1HTR2BGAATSHR | |
| SCHEMBL5315718 | 0.72 | CYP1A2 (0.54) | CYP1A2MAPTLMNACYP3A4TP53 | |
| SCHEMBL5666189 | 0.71 | LMNA (0.39) | CYP1A2MAPTLMNACYP3A4TP53 | |
| SCHEMBL10707636 | 0.70 | MAPT (0.52) | CYP1A2MAPTLMNACYP3A4TP53 | |
| SCHEMBL7213386 | 0.69 | MAPT (0.50) | CYP1A2MAPTLMNACYP3A4TP53 | |
| SCHEMBL877352 | 0.69 | MAPT (0.52) | CYP1A2MAPTLMNACYP3A4TP53 | |
| SCHEMBL9303316 | 0.68 | ALDH1A1 (0.43) | MAPTLMNAMAPK1GAACYP19A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0623606-B1 | Peptidic ketones as interleukin-1beta-converting enzyme inhibitors | SANOFI SA (FR) | 1998-01-07 | — | — | EP | disclosed |
| US-5585486-A | Peptidic ketones as interleukin-1β-converting enzyme inhibitors | STERLING WINTHROP INC. (US) | 1996-12-17 | — | — | US | disclosed |
| US-5462939-A | Peptidic ketones as interleukin-1β-converting enzyme inhibitors | STERLING WINTHROP INC. (US) | 1995-10-31 | — | — | US | disclosed |
| EP-0623606-A2 | Peptidic ketones as interleukin-1beta-converting enzyme inhibitors | STERLING WINTHROP INC. (US) | 1994-11-09 | — | — | EP | disclosed |