Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | GLP1R | P43220 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.40 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | XBP1 | P17861 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9679460 | 0.85 | CYP1A2 (0.43) | GAACYP1A2ALDH1A1KDM4EHPGD | |
| SCHEMBL9679665 | 0.84 | CYP1A2 (0.42) | GAACYP1A2ALDH1A1KDM4EHPGD | |
| SCHEMBL9677200 | 0.77 | CYP1A2 (0.43) | CYP1A2ALDH1A1KDM4EHPGDNOTUM | |
| SCHEMBL9679448 | 0.75 | ALDH1A1 (0.48) | CYP1A2ALDH1A1KDM4EHPGDNOTUM | |
| SCHEMBL24378550 | 0.74 | DPP4 (0.53) | GAACYP1A2ALDH1A1KDM4EHPGD | |
| SCHEMBL9677615 | 0.73 | ALDH1A1 (0.49) | CYP1A2ALDH1A1KDM4EHPGDNOTUM | |
| SCHEMBL10164360 | 0.71 | KDM4E (0.54) | GAAALDH1A1KDM4EHPGDTP53 | |
| SCHEMBL5439236 | 0.71 | GAA (0.52) | GAACYP1A2ALDH1A1KDM4EHPGD | |
| SCHEMBL21177423 | 0.71 | KDM4E (0.45) | GAACYP1A2ALDH1A1KDM4EHPGD | |
| SCHEMBL3327719 | 0.71 | CYP1A2 (0.61) | CYP1A2ALDH1A1KDM4ESMN1; SMN2GABRA2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5064953-A | INTERMEDIATES CEPHALOSPORIN DERIVATIVES | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 1991-11-12 | — | — | US | disclosed |