Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 2/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.40 |
| ▸ | VDR | P11473 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | ALPL | P05186 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8061919 | 0.78 | VDR (0.47) | KEAP1NFE2L2VDRGAAMEN1 | |
| SCHEMBL29244641 | 0.75 | SMN1; SMN2 (0.53) | MMP1MMP13ADAM17KEAP1NFE2L2 | |
| SCHEMBL5870619 | 0.74 | MEN1 (0.54) | ADAM17KEAP1NFE2L2VDRGAA | |
| SCHEMBL13954243 | 0.74 | VDR (0.51) | KEAP1NFE2L2VDRGAAMEN1 | |
| SCHEMBL29596281 | 0.73 | NQO2 (0.47) | KEAP1NFE2L2GAAMEN1ESR1 | |
| SCHEMBL5966612 | 0.73 | NQO2 (0.47) | KEAP1NFE2L2GAAMEN1ESR1 | |
| SCHEMBL13977570 | 0.72 | CA12 (0.41) | KEAP1NFE2L2VDRGAAMEN1 | |
| SCHEMBL14593746 | 0.72 | VDR (0.45) | KEAP1NFE2L2VDRGAAMEN1 | |
| SCHEMBL778393 | 0.72 | ALDH1A1 (0.56) | VDRMEN1KMT2AALDH1A1KDM4E | |
| SCHEMBL5870554 | 0.72 | TP53 (0.53) | VDRMEN1KMT2AALDH1A1HPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6362188-B1 | ANTICANCER AGENTS | SCHERING CORPORATION | 2002-03-26 | — | — | US | disclosed |