Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 5/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | CCR5 | P51681 | 3/20 | 0.52 |
| ▸ | CCR8 | P51685 | 3/20 | 0.52 |
| ▸ | MMP2 | P08253 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | GMNN | O75496 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | MMP9 | P14780 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | MMP8 | P22894 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL253273 | 0.80 | LMNA (0.55) | CCR1LMNAKDM4ECCR5CCR8 | |
| SCHEMBL810237 | 0.80 | CCR1 (0.55) | CCR1LMNAKDM4ECCR5CCR8 | |
| SCHEMBL904366 | 0.79 | METAP2 (0.47) | KDM4EMMP2TSHRMAPTHTT | |
| SCHEMBL7555954 | 0.78 | CCR1 (0.69) | CCR1LMNAKDM4ECCR5CCR8 | |
| SCHEMBL28976977 | 0.76 | CCR1 (0.67) | CCR1LMNAKDM4ECCR5CCR8 | |
| SCHEMBL27654114 | 0.75 | PDE10A (0.59) | CCR1LMNAKDM4ECCR5CCR8 | |
| SCHEMBL12548380 | 0.74 | CCR1 (0.61) | CCR1LMNAKDM4ECCR5CCR8 | |
| SCHEMBL10012244 | 0.74 | CCR1 (0.61) | CCR1LMNAKDM4ECCR5CCR8 | |
| SCHEMBL30331100 | 0.74 | CCR1 (0.61) | CCR1LMNAKDM4ECCR5CCR8 | |
| SCHEMBL12981757 | 0.74 | CCR1 (0.61) | CCR1LMNAKDM4ECCR5CCR8 |
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-6730788-B1 | COUPLING WITH KETONE IN PRESENCE OF LANTHANIDE II METAL COMPOUND | UNIVERSITY OF NOTRE DAME | 2004-05-04 | — | — | US | disclosed |