Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | HPGD | P15428 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | TOP1 | P11387 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6205160 | 0.84 | TP53 (0.44) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL5778912 | 0.69 | HRAS (0.40) | KDM4EMAPTTOP1MEN1KMT2A | |
| SCHEMBL7786957 | 0.69 | ALDH1A1 (0.47) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL7786959 | 0.69 | TP53 (0.46) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| Hydrochloric Acid SCHEMBL8969692 | 0.67 | KDM4E (0.38) | KDM4EMAPTTOP1 | |
| SCHEMBL13117928 | 0.66 | TOP1 (0.57) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL12894978 | 0.66 | TOP1 (0.48) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL21165019 | 0.65 | TOP1 (0.47) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL7595827 | 0.63 | AR (0.31) | — | |
| SCHEMBL6205163 | 0.62 | TP53 (0.42) | ALDH1A1HPGDKDM4EHSD17B10TP53 |
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-5502068-A | ABILITY TO ALKYLATE DNA SEQUENCES | SYNPHAR LABORATORIES, INC. (CA) | 1996-03-26 | — | — | US | disclosed |