Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | STAT1 | P42224 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6170104 | 0.87 | NPC1 (0.54) | CYP1A2MAPTALDH1A1KDM4ENPSR1 | |
| SCHEMBL6177927 | 0.83 | HPGD (0.42) | CYP1A2MAPTALDH1A1KDM4ENPSR1 | |
| SCHEMBL28834473 | 0.77 | MEN1 (0.43) | MAPTALDH1A1KDM4ENPSR1SMN1; SMN2 | |
| SCHEMBL31500060 | 0.73 | SMN1; SMN2 (0.69) | CYP1A2MAPTALDH1A1KDM4ENPSR1 | |
| SCHEMBL6095453 | 0.70 | CYP1A2 (0.59) | CYP1A2MAPTALDH1A1KDM4ENPSR1 | |
| SCHEMBL5800787 | 0.69 | PTGS2 (0.58) | CYP2D6 | |
| SCHEMBL1569938 | 0.68 | HTR7 (0.46) | MAPTALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL13890532 | 0.68 | MEN1 (0.56) | MAPTALDH1A1KDM4ENPSR1SMN1; SMN2 | |
| SCHEMBL6097549 | 0.68 | CYP1A2 (0.56) | CYP1A2MAPTALDH1A1KDM4ENPSR1 | |
| SCHEMBL6096823 | 0.68 | CYP1A2 (0.56) | CYP1A2MAPTALDH1A1KDM4ENPSR1 |
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-1495005-A1 | PYRAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS | Pfizer Japan Inc. (JP) | 2005-01-12 | — | — | EP | disclosed |
| WO-2003087061-A1 | PYRAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS | PFIZER JAPAN INC. (JP) | 2003-10-23 | — | — | WO | disclosed |