Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LEF1 | Q9UJU2 | 1/20 | 0.74 |
| ▸ | MMP13 | P45452 | 2/20 | 0.54 |
| ▸ | XDH | P47989 | 2/20 | 0.50 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | RAB9A | P51151 | 6/20 | 0.43 |
| ▸ | NPC1 | O15118 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | PRNP | P04156 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6619949 | 0.95 | LEF1 (0.81) | LEF1MMP13XDHTP53KDM4E | |
| SCHEMBL3031344 | 0.90 | LEF1 (0.61) | LEF1MMP13XDHRAB9ANPC1 | |
| SCHEMBL3030225 | 0.88 | LEF1 (0.60) | LEF1MMP13MMP2TP53KDM4E | |
| SCHEMBL3027522 | 0.88 | MMP13 (0.72) | LEF1MMP13MMP2KDM4ERAB9A | |
| SCHEMBL13311254 | 0.87 | LEF1 (0.59) | LEF1MMP13MMP2TP53KDM4E | |
| SCHEMBL29830077 | 0.84 | LEF1 (0.67) | LEF1MMP13TP53KDM4ERAB9A | |
| SCHEMBL29783677 | 0.84 | FLT3 (0.59) | LEF1PDGFRBPDGFRAFLT3 | |
| SCHEMBL20742974 | 0.84 | FLT3 (0.59) | LEF1PDGFRBPDGFRAFLT3 | |
| SCHEMBL7833243 | 0.83 | LEF1 (0.55) | LEF1MMP13XDHMMP2TP53 | |
| SCHEMBL14138263 | 0.83 | LEF1 (0.55) | LEF1MMP13MMP2TP53KDM4E |
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 |