Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CASP6 | P55212 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TEC | P42680 | 1/20 | 0.41 |
| ▸ | NCF1 | P14598 | 9/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 3/20 | 0.37 |
| ▸ | NOS3 | P29474 | 2/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6578780 | 0.87 | NCF1 (0.40) | KDM4ELMNAPOLBCASP6ALDH1A1 | |
| SCHEMBL6578833 | 0.87 | NCF1 (0.40) | KDM4ELMNAPOLBCASP6ALDH1A1 | |
| SCHEMBL6576073 | 0.85 | KDM4E (0.38) | KDM4ELMNAPOLBCASP6ALDH1A1 | |
| SCHEMBL8098950 | 0.83 | S1PR4 (0.37) | KDM4ELMNAPOLBCASP6ALDH1A1 | |
| SCHEMBL6581385 | 0.81 | TP53 (0.42) | LMNAALDH1A1CYP2D6CYP1A2NPC1 | |
| SCHEMBL6581464 | 0.80 | KDM4E (0.44) | KDM4ELMNAPOLBCASP6ALDH1A1 | |
| SCHEMBL6935565 | 0.78 | BDKRB2 (0.46) | — | |
| SCHEMBL6580627 | 0.76 | NCF1 (0.41) | KDM4ELMNAPOLBCASP6ALDH1A1 | |
| SCHEMBL6580770 | 0.75 | NCF1 (0.40) | KDM4ELMNAPOLBCASP6ALDH1A1 | |
| SCHEMBL8097174 | 0.75 | BDKRB2 (0.40) | KDM4EALDH1A1NCF1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0796848-B1 | Fluoralkyl- and fluoralkoxy-substituted heterocyclic bradykinin antagonists | HOECHST AG (DE) | 2003-06-04 | — | — | EP | disclosed |
| EP-0796848-A1 | Fluoralkyl- and fluoralkoxy-substituted heterocyclic bradykinin antagonists | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-09-24 | — | — | EP | disclosed |