Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LEF1 | Q9UJU2 | 1/20 | 0.81 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 6/20 | 0.50 |
| ▸ | RAB9A | P51151 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | PRNP | P04156 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | MMP13 | P45452 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | PLD2 | O14939 | 1/20 | 0.47 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.47 |
| ▸ | XDH | P47989 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | PYGL | P06737 | 3/20 | 0.45 |
| ▸ | NHERF1 | O14745 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6617416 | 0.95 | LEF1 (0.74) | LEF1TP53KDM4ENPC1RAB9A | |
| SCHEMBL29830077 | 0.89 | LEF1 (0.67) | LEF1TP53KDM4ENPC1RAB9A | |
| SCHEMBL3031344 | 0.85 | LEF1 (0.61) | LEF1NPC1RAB9AALDH1A1GAA | |
| SCHEMBL20275135 | 0.85 | LEF1 (0.62) | LEF1TP53KDM4ENPC1RAB9A | |
| SCHEMBL19885734 | 0.84 | LEF1 (0.61) | LEF1TP53KDM4ENPC1RAB9A | |
| SCHEMBL3030225 | 0.84 | LEF1 (0.60) | LEF1TP53KDM4EALDH1A1MMP13 | |
| SCHEMBL3027522 | 0.84 | MMP13 (0.72) | LEF1KDM4ENPC1RAB9AALDH1A1 | |
| SCHEMBL13311254 | 0.83 | LEF1 (0.59) | LEF1TP53KDM4ENPC1RAB9A | |
| SCHEMBL5087408 | 0.83 | LEF1 (0.59) | LEF1TP53KDM4ENPC1RAB9A | |
| SCHEMBL6816854 | 0.82 | NPC1 (0.67) | LEF1TP53KDM4ENPC1RAB9A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0983248-B1 | ANALOGS OF DUOCARMYCIN AND CC-1065 | SCRIPPS RESEARCH INST (US) | 2004-07-14 | — | — | EP | disclosed |
| US-6281354-B1 | ANTIBIOTICS; ANTITUMOR AGENTS | THE SCRIPPS RESEARCH INSTITUTE | 2001-08-28 | — | — | US | disclosed |
| EP-0983248-A4 | ANALOGS OF DUOCARMYCIN AND CC-1065 | SCRIPPS RESEARCH INST (US) | 2000-09-13 | — | — | EP | disclosed |
| EP-0983248-A1 | ANALOGS OF DUOCARMYCIN AND CC-1065 | The Scripps Research Institute (US) | 2000-03-08 | — | — | EP | disclosed |
| WO-1998052925-A1 | ANALOGS OF DUOCARMYCIN AND CC-1065 | THE SCRIPPS RESEARCH INSTITUTE (US) | 1998-11-26 | — | — | WO | disclosed |