Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 6/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.45 |
| ▸ | TYR | P14679 | 1/20 | 0.45 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | CASR | P41180 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL7608939 | 0.87 | ERN1 (0.58) | ERN1ALDH1A1TRIM24TYRTRIM33 | |
| SCHEMBL1983140 | 0.81 | HDAC3 (0.52) | ERN1ALDH1A1TRIM24TYRTRIM33 | |
| SCHEMBL5515488 | 0.81 | ERN1 (0.51) | ERN1ALDH1A1TRIM24TYRTRIM33 | |
| SCHEMBL14642539 | 0.81 | ERN1 (0.51) | ERN1ALDH1A1TRIM24TYRTRIM33 | |
| SCHEMBL23512359 | 0.81 | KDM4E (0.49) | ALDH1A1KDM4ECYP1A2CYP2C19CYP2D6 | |
| SCHEMBL28517488 | 0.81 | ERN1 (0.54) | ERN1ALDH1A1TRIM24TYRTRIM33 | |
| SCHEMBL23191292 | 0.80 | GSTP1 (0.62) | ERN1ALDH1A1TRIM24TYRTRIM33 | |
| SCHEMBL19854388 | 0.79 | ERN1 (0.58) | ERN1ALDH1A1TRIM24TYRTRIM33 | |
| SCHEMBL18717026 | 0.79 | ERN1 (0.51) | ERN1ALDH1A1TRIM24TYRTRIM33 | |
| SCHEMBL8917792 | 0.78 | LMNA (0.43) | ERN1ALDH1A1KDM4ESMN1; SMN2MAPT |
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-5622953-A | DRUG RESISTANT TO ANTICANCER CHEMOTHERAPEUTIC DRUG | BASF AKTIENGESELLSCHAFT (DE) | 1997-04-22 | — | — | US | disclosed |