Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8187508 | 0.86 | MEN1 (0.33) | MEN1KMT2ASMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL8197299 | 0.76 | MAPK14 (0.38) | MEN1KMT2ASMN1; SMN2CYP1A2MAPT | |
| SCHEMBL8195495 | 0.76 | TP53 (0.37) | MEN1KMT2ASMN1; SMN2MAPTTP53 | |
| SCHEMBL8195725 | 0.75 | RPS6KA3 (0.40) | MEN1KMT2ASMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL8200074 | 0.75 | LMNA (0.38) | MEN1KMT2ASMN1; SMN2MAPTTP53 | |
| SCHEMBL8197275 | 0.71 | ALDH1A1 (0.36) | SMN1; SMN2MAPTALDH1A1HTTLMNA | |
| SCHEMBL8195827 | 0.70 | PTGS2 (0.40) | KMT2ACYP1A2CYP2C19TP53ALDH1A1 | |
| SCHEMBL8195834 | 0.69 | IKBKE (0.39) | SMN1; SMN2MAPTTP53ALDH1A1 | |
| SCHEMBL8196103 | 0.69 | GRK6 (0.38) | MEN1KMT2ASMN1; SMN2MAPTTP53 | |
| SCHEMBL8199147 | 0.68 | KMO (0.36) | MEN1KMT2ASMN1; SMN2MAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000018741-A2 | PYRAZOLE COMPOUNDS AS COX-2 INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-04-06 | — | — | WO | claimed |
| WO-2000018741-A2 | PYRAZOLE COMPOUNDS AS COX-2 INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-04-06 | — | — | WO | disclosed |