Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 2/20 | 0.64 |
| ▸ | CCR8 | P51685 | 2/20 | 0.64 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | METAP2 | P50579 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALPL | P05186 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | ALPI | P09923 | 1/20 | 0.39 |
| ▸ | ALPG | P10696 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3984954 | 0.98 | CCR1 (0.67) | CCR1CCR8CYP2A6METAP2KDM4E | |
| SCHEMBL3749780 | 0.87 | KDM4E (0.48) | CCR1CCR8KDM4ELMNATP53 | |
| SCHEMBL3753156 | 0.83 | CCR1 (0.76) | CCR1CCR8CYP2A6METAP2KDM4E | |
| SCHEMBL16715989 | 0.83 | CCR1 (0.76) | CCR1CCR8CYP2A6METAP2KDM4E | |
| SCHEMBL3422291 | 0.82 | CCR1 (0.94) | CCR1CCR8CYP2A6METAP2KDM4E | |
| SCHEMBL3423401 | 0.82 | CCR1 (0.94) | CCR1CCR8CYP2A6METAP2KDM4E | |
| Hydrochloric Acid SCHEMBL4171256 | 0.81 | CCR1 (0.73) | CCR1CCR8CYP2A6METAP2KDM4E | |
| SCHEMBL1456176 | 0.81 | CCR1 (0.80) | CCR1CCR8CYP2A6METAP2KDM4E | |
| SCHEMBL1456112 | 0.81 | CCR1 (0.80) | CCR1CCR8CYP2A6METAP2KDM4E | |
| SCHEMBL1456390 | 0.81 | CCR1 (0.80) | CCR1CCR8CYP2A6METAP2KDM4E |
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-2069345-A2 | PYRIDAZINE AND PYRROLE COMPOUNDS, PROCESSES FOR OBTAINING THEM AND USES | Centre National de la Recherche Scientifique (CNRS) (FR) | 2009-06-17 | — | — | EP | disclosed |
| WO-2008012440-A2 | PYRIDAZINE AND PYRROLE COMPOUNDS, PROCESSES FOR OBTAINING THEM AND USES | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) | 2008-01-31 | — | — | WO | disclosed |