Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.44 |
| ▸ | GALR2 | O43603 | 4/20 | 0.42 |
| ▸ | GALR1 | P47211 | 4/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.39 |
| ▸ | CASP1 | P29466 | 2/20 | 0.38 |
| ▸ | CASP5 | P51878 | 2/20 | 0.38 |
| ▸ | GBA1 | P04062 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CASP4 | P49662 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3876785 | 0.99 | GALR2 (0.43) | MALT1GALR2GALR1CNR2ALOX5AP | |
| SCHEMBL3877751 | 0.91 | PIK3CA (0.50) | MALT1MAPTTSHRHSD17B10PIK3CA | |
| SCHEMBL3878564 | 0.91 | GALR2 (0.44) | GALR2GALR1CNR2TRPV1GBA1 | |
| SCHEMBL3888979 | 0.90 | GALR2 (0.46) | GALR2GALR1CNR2TRPV1GBA1 | |
| SCHEMBL3877834 | 0.89 | GALR2 (0.55) | GALR2GALR1TRPV1 | |
| SCHEMBL3876607 | 0.89 | GALR2 (0.56) | GALR2GALR1TRPV1 | |
| SCHEMBL3885408 | 0.88 | GALR2 (0.55) | GALR2GALR1TRPV1 | |
| SCHEMBL3878113 | 0.87 | MALT1 (0.47) | MALT1TRPV1 | |
| SCHEMBL3878601 | 0.87 | TRPV1 (0.49) | MALT1GALR2GALR1TRPV1 | |
| SCHEMBL3879608 | 0.87 | TRPV1 (0.49) | MALT1GALR2GALR1TRPV1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7566712-B2 | Biaryl piperazinyl-pyridine analogues | NEUROGEN CORPORATION (US) | 2009-07-28 | — | — | US | disclosed |
| US-7566712-B2 | Biaryl piperazinyl-pyridine analogues | NEUROGEN CORPORATION (US) | 2009-07-28 | — | — | US | disclosed |
| US-7566712-B2 | Biaryl piperazinyl-pyridine analogues | NEUROGEN CORPORATION (US) | 2009-07-28 | — | — | US | disclosed |