Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HMOX1 | P09601 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.30 |
| ▸ | CCR6 | P51684 | 1/20 | 0.30 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20153033 | 0.69 | NPSR1 (0.48) | ALOX15ALOX12CCR6HKDC1 | |
| SCHEMBL14755519 | 0.65 | NPSR1 (0.34) | KDM4EALOX15ALOX12CCR6HKDC1 | |
| SCHEMBL5698265 | 0.63 | ALOX15 (0.43) | KDM4EALOX15ALOX12CCR6 | |
| SCHEMBL6743198 | 0.61 | ALOX15 (0.40) | KDM4EALOX15ALOX12CCR6 | |
| SCHEMBL12572587 | 0.61 | ALOX15 (0.48) | KDM4EALOX15ALOX12CCR6 | |
| SCHEMBL18886587 | 0.60 | KDM4E (0.37) | KDM4EALOX15ALOX12 | |
| SCHEMBL14755490 | 0.59 | HTR2A (0.44) | ALOX15 | |
| SCHEMBL27721741 | 0.59 | NPSR1 (0.53) | CCR6HKDC1 | |
| SCHEMBL16736874 | 0.59 | ALOX15 (0.41) | KDM4EALOX15ALOX12CCR6 | |
| SCHEMBL4183452 | 0.58 | NPSR1 (0.43) | KDM4ECCR6HKDC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018086197-A1 | CATALYTIC ASYMMETRIC SYNTHESIS METHOD FOR CHIRAL SPINOL DERIVATE | 南方科技大学 | 2018-05-17 | — | — | WO | disclosed |