Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5728312 | 0.80 | TP53 (0.46) | RAB9ATP53ALDH1A1KDM4ENPC1 | |
| SCHEMBL5740873 | 0.75 | HPGD (0.40) | GAASMN1; SMN2TP53TSHRALDH1A1 | |
| SCHEMBL5728176 | 0.75 | CCNT1 (0.42) | TP53ALDH1A1 | |
| SCHEMBL5728418 | 0.73 | TACR1 (0.36) | GAATP53ALDH1A1TDP1RECQL | |
| SCHEMBL5727679 | 0.71 | RECQL (0.40) | GAASMN1; SMN2CYP2D6TSHRALDH1A1 | |
| SCHEMBL545742 | 0.68 | MAPK1 (0.67) | GAATSHRCYP2C19ALDH1A1KDM4E | |
| SCHEMBL5727635 | 0.65 | MAOB (0.41) | SMN1; SMN2RAB9ATP53CYP1A2CYP2C19 | |
| SCHEMBL5739111 | 0.64 | AKT1 (0.41) | RAB9ANPC1RECQL | |
| SCHEMBL2107820 | 0.63 | GAA (0.51) | GAAMAPTSMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL210873 | 0.61 | CA1 (0.53) | MAPTSMN1; SMN2RAB9ACYP1A2NPC1 |
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-1651613-A1 | 4,5-DIHYDRO-IMIDAZOLE AS P2X7 ION CHANNEL BLOCKERS | Aventis Pharmaceuticals, Inc. (US) | 2006-05-03 | — | — | EP | disclosed |
| WO-2005014555-A1 | 4,5-DIHYDRO-IMIDAZOLE AS P2X7 ION CHANNEL BLOCKERS | AVENTIS PHARMACEUTICALS INC. (US) | 2005-02-17 | — | — | WO | disclosed |