Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 7/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MGMT | P16455 | 1/20 | 0.33 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9761212 | 0.80 | PARP1 (0.36) | CYP1A2CYP2C9ALDH1A1CYP2C19HTT | |
| SCHEMBL9760948 | 0.77 | CYP1A2 (0.36) | CYP1A2CYP2C9ALDH1A1CYP2C19MAPT | |
| SCHEMBL9762223 | 0.76 | ALDH1A1 (0.46) | CYP1A2CYP2C9ALDH1A1CYP2C19HTT | |
| SCHEMBL9761459 | 0.76 | ALDH1A1 (0.39) | CYP1A2CYP2C9ALDH1A1CYP2C19MAPT | |
| SCHEMBL9761856 | 0.73 | KMT2A (0.40) | CYP1A2CYP2C9ALDH1A1CYP2C19HTT | |
| SCHEMBL9761370 | 0.73 | KDM4E (0.34) | KMT2AMEN1 | |
| SCHEMBL9761621 | 0.70 | CYP1A2 (0.39) | CYP1A2CYP2C9ALDH1A1CYP2C19CYP2D6 | |
| SCHEMBL9761579 | 0.69 | MEN1 (0.32) | KMT2AMEN1 | |
| SCHEMBL9762538 | 0.67 | SMN1; SMN2 (0.38) | CYP1A2CYP2C9ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL9761142 | 0.65 | NPC1 (0.46) | CYP1A2CYP2C9CYP2C19MAPTKMT2A |
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-5026694-A | Antitumor agents | THE BRITISH COLUMBIA CANCER FOUNDATION (CA) | 1991-06-25 | — | — | US | disclosed |