Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 8/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL14229578 | 0.90 | RIPK1 (0.34) | IDO1RIPK1NPSR1TSHRLMNA | |
| SCHEMBL14201013 | 0.90 | CYP1A2 (0.34) | IDO1RIPK1NPSR1CYP1A2CYP2D6 | |
| SCHEMBL14201017 | 0.90 | CYP1A2 (0.34) | IDO1RIPK1NPSR1CYP1A2CYP2D6 | |
| SCHEMBL14201039 | 0.88 | IDO1 (0.33) | IDO1RIPK1NPSR1CYP1A2CYP2D6 | |
| SCHEMBL14200734 | 0.85 | RIPK1 (0.34) | RIPK1CYP1A2CYP2C19 | |
| SCHEMBL14200498 | 0.85 | RIPK1 (0.39) | RIPK1HDAC8 | |
| SCHEMBL14200858 | 0.85 | CYP1A2 (0.33) | IDO1RIPK1NPSR1CYP1A2CYP2D6 | |
| SCHEMBL14200486 | 0.84 | ALDH1A1 (0.44) | TSHRLMNAKDM4EALDH1A1 | |
| SCHEMBL14229460 | 0.84 | NPSR1 (0.37) | IDO1NPSR1TSHRLMNACYP1A2 | |
| SCHEMBL14201008 | 0.83 | CHRNA1 (0.37) | TSHRLMNACYP1A2CYP2C9CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |
| US-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |