Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.62 |
| ▸ | ORAI1 | Q96D31 | 3/20 | 0.61 |
| ▸ | TRPC3 | Q13507 | 3/20 | 0.60 |
| ▸ | TRPC1 | P48995 | 1/20 | 0.60 |
| ▸ | STIM1 | Q13586 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 6/20 | 0.59 |
| ▸ | THRB | P10828 | 2/20 | 0.58 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.56 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.52 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.52 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CRACR2A | Q9BSW2 | 2/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7319407 | 0.93 | TP53 (0.64) | TP53ORAI1TRPC3TRPC1STIM1 | |
| SCHEMBL7320311 | 0.88 | ORAI1 (0.67) | TP53ORAI1TRPC3TRPC1STIM1 | |
| SCHEMBL7315526 | 0.88 | TP53 (0.71) | TP53ORAI1TRPC3TRPC1STIM1 | |
| SCHEMBL7233105 | 0.87 | ORAI1 (0.70) | TP53ORAI1TRPC3TRPC1STIM1 | |
| SCHEMBL7314472 | 0.87 | TP53 (0.67) | TP53ORAI1TRPC3TRPC1STIM1 | |
| SCHEMBL7313426 | 0.84 | ORAI1 (0.67) | TP53ORAI1TRPC3TRPC1STIM1 | |
| SCHEMBL7327901 | 0.83 | ORAI1 (0.67) | TP53ORAI1TRPC3TRPC1STIM1 | |
| SCHEMBL7325234 | 0.82 | ORAI1 (0.67) | TP53ORAI1TRPC3TRPC1STIM1 | |
| SCHEMBL7327988 | 0.82 | ORAI1 (0.81) | TP53ORAI1TRPC3TRPC1STIM1 | |
| SCHEMBL7317754 | 0.82 | ORAI1 (0.81) | TP53ORAI1TRPC3TRPC1STIM1 |
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-6506747-B1 | Method of treating an inflammatory disease which comprises administering to a patient in need of such treatment-a N-(4-(5-Ethyl-3-pyridin-3-yl-pyrazol-1-yl)phenyl)pyridine-3-carboxamide; | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. | 2003-01-14 | — | — | US | disclosed |