Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 1/20 | 0.53 |
| ▸ | NAMPT | P43490 | 1/20 | 0.52 |
| ▸ | KDR | P35968 | 6/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.50 |
| ▸ | PYGL | P06737 | 1/20 | 0.49 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL846549 | 1.00 | DHODH (0.53) | DHODHNAMPTKDRMAPTKDM4E | |
| SCHEMBL846401 | 0.87 | NAMPT (0.51) | NAMPTKDRMAPTKDM4EALDH1A1 | |
| SCHEMBL846400 | 0.87 | NAMPT (0.51) | NAMPTKDRMAPTKDM4EALDH1A1 | |
| SCHEMBL16101601 | 0.85 | KDR (0.60) | NAMPTKDRMAPTKDM4EALDH1A1 | |
| SCHEMBL13991500 | 0.85 | KDR (0.60) | NAMPTKDRMAPTKDM4EALDH1A1 | |
| SCHEMBL13991503 | 0.83 | RAB9A (0.65) | NAMPTKDRMAPTKDM4EALDH1A1 | |
| SCHEMBL846863 | 0.81 | MAOB (0.57) | NAMPTKDRMAPTKDM4EALDH1A1 | |
| SCHEMBL846062 | 0.81 | TRPV1 (0.67) | KDRMAPTKDM4ELMNARAB9A | |
| SCHEMBL846432 | 0.81 | MAOB (0.59) | KDRMAPTKDM4EALDH1A1LMNA | |
| SCHEMBL846862 | 0.81 | MAOB (0.57) | NAMPTKDRMAPTKDM4EALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1603883-B1 | QUINOLINE-DERIVED AMIDE MODULATORS OF VANILLOID VR1 RECEPTOR | JANSSEN PHARMACEUTICA NV (BE) | 2012-03-28 | — | — | EP | disclosed |
| EP-2308848-A1 | Quinoline-derived amide modulators of vanilloid VR1 receptor | Janssen Pharmaceutica NV (BE) | 2011-04-13 | — | — | EP | disclosed |