Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.37 |
| ▸ | COMT | P21964 | 1/20 | 0.37 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL3262644 | 0.84 | ATM (0.46) | ATMPTGS2ALDH1A1MEN1MAPT | |
| SCHEMBL28143996 | 0.82 | ATM (0.47) | ATMALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL5312009 | 0.72 | PTGS2 (0.76) | PTGS2 | |
| SCHEMBL14030743 | 0.70 | TSHR (0.46) | PTGS2ALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL7186907 | 0.68 | CYP3A4 (0.44) | PTGS2ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL3433959 | 0.67 | NOTUM (0.49) | ALDH1A1MEN1MAPTKMT2ASMN1; SMN2 | |
| SCHEMBL28129191 | 0.67 | ATM (0.48) | ATMPTGS2ALDH1A1MEN1MAPT | |
| SCHEMBL1127502 | 0.67 | ATM (0.48) | ATMALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL8505536 | 0.66 | PTGS2 (0.39) | PTGS2SMN1; SMN2NOTUMDDB1CRBN | |
| SCHEMBL11101049 | 0.66 | PSIP1 (0.41) | ATMALDH1A1MEN1MAPTKMT2A |
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-0946507-A1 | SUBSTITUTED PYRROLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1999-10-06 | — | — | EP | disclosed |
| WO-1998025896-A1 | SUBSTITUTED PYRROLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1998-06-18 | — | — | WO | disclosed |