Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.42 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 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 | |
|---|---|---|---|---|
| SCHEMBL1924026 | 0.84 | KDM4E (0.50) | ADORA2AADORA1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL2489517 | 0.80 | ADORA2A (0.46) | ADORA2AADORA1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL2912056 | 0.73 | ALDH1A1 (0.61) | ALDH1A1CHRNA7KMT2ARAB9AKDM4E | |
| SCHEMBL2325547 | 0.72 | ALDH1A1 (0.53) | ALDH1A1KMT2AKDM4EMEN1SMN1; SMN2 | |
| SCHEMBL2491953 | 0.72 | ALDH1A1 (0.49) | ADORA2AADORA1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL2492125 | 0.72 | TRPV1 (0.46) | ADORA2AADORA1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL2491635 | 0.72 | ADORA2A (0.50) | ADORA2AADORA1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL1641681 | 0.71 | ALDH1A1 (0.58) | ALDH1A1CHRNA7KMT2ARAB9AKDM4E | |
| SCHEMBL11194277 | 0.70 | ALDH1A1 (0.73) | ALDH1A1CYP2D6CYP2C19CHRNA7KMT2A | |
| SCHEMBL16793140 | 0.70 | BACE1 (0.55) | ALDH1A1CYP2D6CYP2C19CYP1A2GRIN2B |
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-1434579-A1 | IMIDAZOLE DERIVATIVES AS ANTIINFLAMMATORY AGENTS | Tularik Inc. (US) | 2004-07-07 | — | — | EP | disclosed |
| WO-2003030902-A1 | IMIDAZOLE DERIVATES AS ANTI-INFLAMMATORY AGENTS | TULARIK INC. (US) | 2003-04-17 | — | — | WO | disclosed |