Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 2/20 | 0.72 |
| ▸ | NPC1 | O15118 | 7/20 | 0.66 |
| ▸ | RAB9A | P51151 | 6/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.66 |
| ▸ | MITF | O75030 | 1/20 | 0.66 |
| ▸ | XBP1 | P17861 | 1/20 | 0.66 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.66 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.64 |
| ▸ | TRPV1 | Q8NER1 | 11/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.57 |
| ▸ | USP2 | O75604 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | PKM | P14618 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL845964 | 0.93 | KDR (0.68) | KDRNPC1RAB9AKDM4EMITF | |
| SCHEMBL848116 | 0.92 | NPC1 (0.65) | KDRNPC1RAB9AKDM4EMITF | |
| SCHEMBL846030 | 0.92 | KDR (0.67) | KDRNPC1RAB9AKDM4EMITF | |
| SCHEMBL846074 | 0.92 | KDR (0.67) | KDRNPC1RAB9AKDM4EMITF | |
| SCHEMBL846300 | 0.92 | KDR (0.67) | KDRNPC1RAB9AKDM4EMITF | |
| SCHEMBL846379 | 0.92 | KDR (0.67) | KDRNPC1RAB9AKDM4EMITF | |
| SCHEMBL845220 | 0.91 | NPC1 (0.66) | KDRNPC1RAB9AKDM4EMITF | |
| SCHEMBL846520 | 0.90 | KDR (0.64) | KDRNPC1RAB9AKDM4EMITF | |
| SCHEMBL846927 | 0.90 | KDR (0.64) | KDRNPC1RAB9AKDM4EMITF | |
| SCHEMBL846408 | 0.90 | KDR (0.64) | KDRNPC1RAB9AKDM4EMITF |
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 |