Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | NPY1R | P25929 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | LY6K | Q17RY6 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 5/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7468982 | 0.86 | ALDH1A1 (0.45) | ALDH1A1GAANPY1RSMN1; SMN2HPGD | |
| SCHEMBL7476854 | 0.82 | PTGS1 (0.37) | ALDH1A1GAANPY1RSMN1; SMN2 | |
| SCHEMBL7462801 | 0.80 | CCR4 (0.36) | SMN1; SMN2LY6KHPGDLMNAHSD17B10 | |
| SCHEMBL7467654 | 0.74 | NPY1R (0.37) | ALDH1A1GAANPY1RSMN1; SMN2HSD17B10 | |
| SCHEMBL7476942 | 0.73 | ALDH1A1 (0.38) | ALDH1A1GAANPY1RSMN1; SMN2HPGD | |
| SCHEMBL7822145 | 0.69 | GAA (0.40) | ALDH1A1GAASMN1; SMN2HPGDHSD17B10 | |
| SCHEMBL7465420 | 0.68 | SMN1; SMN2 (0.33) | ALDH1A1GAANPY1RSMN1; SMN2LMNA | |
| SCHEMBL7470942 | 0.68 | L3MBTL1 (0.37) | ALDH1A1GAASMN1; SMN2HPGDLMNA | |
| SCHEMBL7810829 | 0.68 | NQO2 (0.33) | LMNANPC1MAPTRECQL | |
| SCHEMBL7811964 | 0.68 | NQO2 (0.33) | LMNANPC1MAPTRECQL |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0783495-B1 | QUINOXALINE DERIVATIVES USEFUL IN THERAPY | PFIZER LTD (GB) | 2002-02-27 | — | — | EP | disclosed |
| US-5852016-A | Quinoxaline derivatives useful in therapy | PFIZER INC. (US) | 1998-12-22 | — | — | US | disclosed |
| WO-1996009295-A1 | QUINOXALINE DERIVATIVES USEFUL IN THERAPY | PFIZER LIMITED (GB) | 1996-03-28 | — | — | WO | disclosed |