Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.68 |
| ▸ | PARP1 | P09874 | 1/20 | 0.56 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | PRKCA | P17252 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | MDH2 | P40926 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
| ▸ | RGS12 | O14924 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8313203 | 0.81 | NQO1 (1.00) | NQO1SIRT2ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL9622806 | 0.80 | NQO1 (0.67) | NQO1PARP1SIRT2ALDH1A1HPGD | |
| SCHEMBL5828673 | 0.73 | PARP1 (1.00) | PARP1MEN1KMT2APRKCAMAPT | |
| SCHEMBL9623177 | 0.72 | NQO1 (0.71) | NQO1PARP1SIRT2ALDH1A1HPGD | |
| SCHEMBL8324352 | 0.72 | NQO1 (0.74) | NQO1KDM4EMEN1KMT2APRKCA | |
| SCHEMBL13431714 | 0.71 | NQO1 (0.73) | NQO1PARP1SIRT2ALDH1A1SMN1; SMN2 | |
| SCHEMBL14560575 | 0.69 | CHEK1 (0.51) | NQO1PARP1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL8316860 | 0.69 | NQO1 (0.70) | NQO1SMN1; SMN2MEN1KMT2APRKCA | |
| SCHEMBL8318378 | 0.68 | NQO1 (0.68) | NQO1ALDH1A1HPGDSMN1; SMN2MEN1 | |
| SCHEMBL8133525 | 0.66 | ELANE (0.61) | ALDH1A1HPGDKDM4EMEN1KMT2A |
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-5166204-A | ISOINDOLE DERIVATIVES AND SALTS THEREOF AND ANTITUMOR AGENT COMPRISING THE SAME | TOYAMA CHEMICAL CO., LTD. (JP) | 1992-11-24 | — | — | US | disclosed |