Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | GLA | P06280 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.43 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | PTPRA | P18433 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8796437 | 0.81 | KDM1A (0.43) | ALDH1A1MAPTTDP1SMN1; SMN2CYP2D6 | |
| Acridine SCHEMBL27871863 | 0.75 | KMT2A (0.43) | ALDH1A1KMT2AGLAHPGDKDM4E | |
| SCHEMBL30018410 | 0.68 | KMT2A (0.47) | ALDH1A1KMT2AGLAHPGDKDM4E | |
| SCHEMBL27288856 | 0.67 | SMN1; SMN2 (0.51) | ALDH1A1KMT2AGAAPOLBMAPT | |
| SCHEMBL8951248 | 0.67 | MAPT (0.44) | ALDH1A1KMT2AHPGDGAARAB9A | |
| Acridine SCHEMBL27603600 | 0.67 | ALDH1A1 (0.94) | ALDH1A1KMT2AGLAHPGDKDM4E | |
| SCHEMBL4655299 | 0.66 | MAPT (0.66) | ALDH1A1HPGDKDM4EGAAMAPT | |
| Acridine SCHEMBL27523545 | 0.66 | ALDH1A1 (0.71) | ALDH1A1KMT2AGLAHPGDKDM4E | |
| SCHEMBL4299906 | 0.65 | ALDH1A1 (0.70) | ALDH1A1KMT2AGLAHPGDKDM4E | |
| Acridine SCHEMBL8339 | 0.65 | ALDH1A1 (1.00) | ALDH1A1KMT2AGLAHPGDKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004024058-A2 | MOLECULES WITH ANTITUMOR ACTIVITY AND CHEMICAL SYNTHESIS | CONSELHO NACIONAL DE DESENVOLVIMENTO CIENTÍFICO E TECNOLÓGICO - CNPQ (BR) | 2004-03-25 | — | — | WO | disclosed |