Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.35 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | WEE1 | P30291 | 1/20 | 0.34 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.34 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.34 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.34 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.34 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.34 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11400171 | 0.88 | CASP3 (0.37) | ALDH1A1CASP3MEN1KMT2AGAA | |
| SCHEMBL10895518 | 0.82 | GAA (0.39) | ALDH1A1CASP3GAAKDM4EHPGD | |
| SCHEMBL7648225 | 0.82 | CYP2A6 (0.43) | ALDH1A1CASP3MEN1KMT2AGAA | |
| SCHEMBL7399139 | 0.81 | DDB1 (0.46) | ALDH1A1CASP3MEN1KMT2AGAA | |
| Water SCHEMBL8678456 | 0.80 | DDB1 (0.45) | ALDH1A1CASP3MEN1KMT2AGAA | |
| SCHEMBL10776993 | 0.76 | CDK2 (0.43) | ALDH1A1CASP3MEN1KMT2AGAA | |
| SCHEMBL11064554 | 0.76 | KCNA3 (0.40) | ALDH1A1CASP3GAAKDM4EHPGD | |
| SCHEMBL17154508 | 0.75 | KCNA3 (0.40) | ALDH1A1CASP3GAAKDM4EHPGD | |
| SCHEMBL17154500 | 0.75 | HTR7 (0.51) | ALDH1A1KDM4E | |
| SCHEMBL9596671 | 0.75 | KCNA3 (0.42) | ALDH1A1CASP3GAAKDM4EHPGD |
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-4782158-A | CEPHEM ANTIBIOTIC INTERMEDIATES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1988-11-01 | — | — | US | disclosed |