Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | TRPC3 | Q13507 | 3/20 | 0.42 |
| ▸ | ORAI1 | Q96D31 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | TRPC1 | P48995 | 1/20 | 0.39 |
| ▸ | STIM1 | Q13586 | 1/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TRPC5 | Q9UL62 | 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 | |
|---|---|---|---|---|
| SCHEMBL7570850 | 0.80 | PTGS1 (0.65) | PTGS1TP53TRPC3ORAI1MAPT | |
| SCHEMBL7326735 | 0.76 | TRPC3 (0.41) | PTGS1TP53TRPC3ORAI1MAPT | |
| SCHEMBL7326745 | 0.76 | TRPC3 (0.41) | PTGS1TP53TRPC3ORAI1MAPT | |
| SCHEMBL19692476 | 0.74 | PTGS2 (0.65) | PTGS1TP53TRPC3ORAI1MAPT | |
| SCHEMBL3561092 | 0.74 | TRPC3 (0.51) | PTGS1TP53TRPC3ORAI1MAPT | |
| SCHEMBL7233640 | 0.73 | TRPC3 (0.48) | PTGS1TP53TRPC3ORAI1MAPT | |
| SCHEMBL3277337 | 0.71 | PTGS2 (0.55) | PTGS1TP53TRPC3ORAI1MAPT | |
| SCHEMBL15420349 | 0.71 | ORAI1 (0.53) | PTGS1TP53TRPC3ORAI1MAPT | |
| SCHEMBL14198876 | 0.71 | TRPC3 (0.69) | PTGS1TP53TRPC3ORAI1MAPT | |
| SCHEMBL19692382 | 0.71 | PTGS2 (0.53) | PTGS1TP53TRPC3ORAI1MAPT |
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 |