Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.46 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.44 |
| ▸ | ALPL | P05186 | 1/20 | 0.44 |
| ▸ | TDO2 | P48775 | 1/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 8/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.42 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3724188 | 0.83 | KDR (0.46) | ALPLNPC1RAB9AABL1KDM4E | |
| SCHEMBL13264574 | 0.81 | AKT2 (0.60) | IKBKBMAP3K14MAP4K4 | |
| SCHEMBL17619924 | 0.79 | MAPK14 (0.49) | MKNK1MKNK2TDO2MAP4K4RAB9A | |
| SCHEMBL544598 | 0.78 | MAP4K4 (0.48) | MKNK1MKNK2TDO2MAP4K4CYP1A2 | |
| SCHEMBL24962591 | 0.78 | IKBKB (0.41) | IKBKBMAP3K14NPC1RAB9A | |
| SCHEMBL7096615 | 0.78 | KMT2A (0.38) | CYP1A2NPC1RAB9AKDM4EHPGD | |
| SCHEMBL1925085 | 0.77 | IMPDH2 (0.43) | CYP1A2NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL1247672 | 0.75 | KIF11 (0.48) | MKNK1MKNK2MAP4K4NPC1RAB9A | |
| SCHEMBL5872525 | 0.75 | HSP90AA1 (0.45) | ALPLRAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL22425324 | 0.73 | ALDH1A1 (0.39) | CYP1A2NPC1RAB9AABL1KDM4E |
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-5132424-A | Anticholesterol, treatment of atherosclerosis | THE UPJOHN COMPANY (US) | 1992-07-21 | — | — | US | disclosed |
| EP-0425541-A1 | PYRAZOLO-AZOLO-PYRIMIDINE-DIONES | THE UPJOHN COMPANY (US) | 1991-05-08 | — | — | EP | disclosed |
| WO-1990001031-A1 | PYRAZOLO-PYRROLO-PYRIMIDINE-DIONES | THE UPJOHN COMPANY (US) | 1990-02-08 | — | — | WO | disclosed |