Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.59 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.49 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.46 |
| ▸ | FEN1 | P39748 | 1/20 | 0.46 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.45 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.45 |
| ▸ | POLQ | O75417 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | SRC | P12931 | 1/20 | 0.41 |
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | BCR | P11274 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1936008 | 0.85 | KIF11 (0.59) | KIF11S1PR1S1PR3CYP19A1CYP11B1 | |
| SCHEMBL1935130 | 0.81 | TRPA1 (0.50) | KIF11S1PR1S1PR3CYP11B1CYP11B2 | |
| SCHEMBL4781603 | 0.81 | KIF11 (0.54) | KIF11S1PR1S1PR3CYP19A1CYP11B1 | |
| SCHEMBL8103776 | 0.80 | TSHR (0.66) | KIF11S1PR1S1PR3PDE3BPDE3A | |
| SCHEMBL16529012 | 0.80 | KIF11 (0.57) | KIF11S1PR1S1PR3CYP19A1CYP11B1 | |
| SCHEMBL1934757 | 0.80 | S1PR1 (0.48) | KIF11S1PR1S1PR3PDE3BPDE3A | |
| SCHEMBL28676412 | 0.80 | TSHR (0.56) | KIF11ALOX5APFEN1CES2ABCC8 | |
| SCHEMBL24017166 | 0.79 | CES2 (0.46) | KIF11ALOX5APFEN1CES2ABCC8 | |
| SCHEMBL28675904 | 0.78 | ALOX5AP (0.46) | KIF11ALOX5APFEN1CES2ABCC8 | |
| SCHEMBL3537298 | 0.78 | ALOX5AP (0.43) | KIF11ALOX5APFEN1CES2ABCC8 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103254250-B | Ferrocenyl pyridine cyclic Pd-N heterocyclic carbene compound as well as preparation method and application thereof | UNIV LUOYANG NORMAL | 2015-06-10 | — | — | CN | disclosed |