Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 11/20 | 0.45 |
| ▸ | PARP1 | P09874 | 2/20 | 0.45 |
| ▸ | PBRM1 | Q86U86 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29029750 | 0.86 | ELANE (0.49) | ELANEPARP1 | |
| SCHEMBL31607526 | 0.78 | ELANE (0.44) | ELANEPARP1CYP3A4DHODH | |
| SCHEMBL1563528 | 0.78 | ELANE (0.44) | ELANEPARP1CYP3A4DHODH | |
| SCHEMBL10506653 | 0.78 | CYP3A4 (0.39) | ELANEPARP1CYP3A4TSHR | |
| SCHEMBL9493680 | 0.77 | CYP3A4 (0.38) | ELANEPARP1PBRM1CYP3A4TSHR | |
| SCHEMBL9492598 | 0.75 | ELANE (0.44) | ELANEPARP1CYP3A4TSHR | |
| SCHEMBL9495292 | 0.73 | MAOA (0.47) | CYP3A4 | |
| SCHEMBL11107678 | 0.72 | ELANE (0.40) | ELANEPARP1DHODH | |
| SCHEMBL9493505 | 0.72 | CYP3A4 (0.36) | ELANEPARP1PBRM1CYP3A4TSHR | |
| SCHEMBL11104609 | 0.71 | CYP3A4 (0.36) | CYP3A4TSHR |
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-0113432-B1 | CHLOROMETHYL QUINOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE | ALKALOIDA VEGYéSZETI GYáR (HU) | 1993-03-17 | — | — | EP | claimed |
| EP-0113432-A1 | Chloromethyl quinoline derivatives, process for their preparation and their use | ALKALOIDA VEGYéSZETI GYáR (HU) | 1984-07-18 | — | — | EP | claimed |