Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 4/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | SCN10A | Q9Y5Y9 | 3/20 | 0.36 |
| ▸ | ERN1 | O75460 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16080787 | 0.99 | CYP2C19 (0.53) | CYP2C19CYP1A2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL29512280 | 0.91 | CYP1A2 (0.51) | CYP2C19CYP1A2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL16100684 | 0.91 | CYP1A2 (0.51) | CYP2C19CYP1A2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL16094326 | 0.90 | CYP1A2 (0.54) | CYP2C19CYP1A2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL16095478 | 0.90 | CYP1A2 (0.54) | CYP2C19CYP1A2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL16080786 | 0.86 | CYP1A2 (0.42) | CYP2C19CYP1A2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL16080792 | 0.85 | CYP1A2 (0.42) | CYP2C19CYP1A2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL16119766 | 0.85 | CYP1A2 (0.49) | CYP2C19CYP1A2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL16033977 | 0.85 | CYP1A2 (0.49) | CYP2C19CYP1A2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL16034915 | 0.85 | CYP1A2 (0.49) | CYP2C19CYP1A2CYP2C9CYP3A4CYP2C8 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2968299-B1 | COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN | GLOBAL BLOOD THERAPEUTICS INC (US) | 2021-01-20 | — | — | EP | disclosed |