Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DOT1L | Q8TEK3 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.36 |
| ▸ | ADCY5 | O95622 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | THPO | P40225 | 1/20 | 0.34 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | MARS1 | P56192 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | IARS1 | P41252 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8464093 | 1.00 | DOT1L (0.39) | DOT1LADORA1ADCY5CYP1A2CYP3A4 | |
| SCHEMBL8465925 | 0.91 | ADCY5 (0.36) | ADORA1ADCY5MARS1ADORA2AIARS1 | |
| SCHEMBL8467662 | 0.91 | ADCY5 (0.36) | ADORA1ADCY5MARS1ADORA2AIARS1 | |
| SCHEMBL8464285 | 0.90 | P2RY1 (0.43) | DOT1LADCY5MARS1IARS1 | |
| SCHEMBL8467074 | 0.90 | P2RY1 (0.43) | DOT1LADCY5MARS1IARS1 | |
| SCHEMBL8466911 | 0.88 | ADCY5 (0.37) | ADCY5MARS1ADORA2A | |
| SCHEMBL8465859 | 0.88 | ADCY5 (0.47) | ADORA1ADCY5ADORA2A | |
| SCHEMBL8466600 | 0.88 | ADCY5 (0.47) | ADORA1ADCY5ADORA2A | |
| SCHEMBL8464251 | 0.87 | ADCY5 (0.36) | ADCY5 | |
| SCHEMBL8467714 | 0.87 | ADCY5 (0.36) | ADCY5MARS1ADORA2A |
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-5994361-A | ANTITUMOR, ANTICANCER AGENT | BIOCHEM PHARMA (CA) | 1999-11-30 | — | — | US | claimed |