Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 6/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9700304 | 0.84 | KDM4E (0.39) | KDM4ECYP1A2CYP3A4ALDH1A1CYP2D6 | |
| SCHEMBL9213212 | 0.80 | TBXA2R (0.39) | KDM4EALDH1A1TBXA2RNOD2P2RX3 | |
| SCHEMBL9682366 | 0.79 | TBXA2R (0.50) | KDM4ECYP1A2CYP3A4ALDH1A1CYP2D6 | |
| SCHEMBL9683033 | 0.74 | TBXA2R (0.54) | TBXA2RP2RX3 | |
| SCHEMBL3103170 | 0.71 | TBXA2R (0.48) | KDM4ECYP1A2CYP3A4ALDH1A1CYP2C9 | |
| SCHEMBL9273498 | 0.68 | TBXA2R (0.66) | KDM4ECYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9682976 | 0.68 | NOD1 (0.40) | KDM4ECYP1A2CYP3A4ALDH1A1CYP2D6 | |
| SCHEMBL9681816 | 0.68 | TBXA2R (0.71) | TBXA2R | |
| SCHEMBL9700294 | 0.67 | ALDH1A1 (0.48) | KDM4ECYP1A2CYP3A4ALDH1A1CYP2D6 | |
| SCHEMBL9681545 | 0.65 | TBXA2R (0.55) | TBXA2RP2RX3 |
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-5128359-A | Benzimidazole and azabenzimidazole derivatives which are thromboxane receptor antagonists, their methods of preparation | LABORATOIRES UPSA (FR) | 1992-07-07 | — | — | US | disclosed |