Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.43 |
| ▸ | CCR5 | P51681 | 1/20 | 0.43 |
| ▸ | CCR8 | P51685 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | METAP2 | P50579 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | STAT3 | P40763 | 1/20 | 0.32 |
| ▸ | STAT1 | P42224 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.30 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6902595 | 0.79 | CCR1 (0.43) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL6902522 | 0.79 | CCR1 (0.37) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL6902452 | 0.78 | KDM4E (0.42) | CCR1CCR5CCR8CYP2A6METAP2 | |
| SCHEMBL7031934 | 0.78 | NPC1 (0.31) | NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL6903898 | 0.78 | CYP3A4 (0.37) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL6903470 | 0.76 | CCR1 (0.37) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL6902400 | 0.76 | CCR1 (0.37) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL6904291 | 0.76 | CCR1 (0.37) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL6899180 | 0.75 | KDM4E (0.35) | CCR1CCR5CCR8HDAC6METAP2 | |
| SCHEMBL6902359 | 0.72 | CYP3A4 (0.36) | CCR1CCR5CCR8HDAC6CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1033371-B1 | Transition metal compound, catalyst system, process for the preparation thereof and its use for the polymerization of olefins | BASELL POLYOLEFINE GMBH (DE) | 2004-01-28 | — | — | EP | claimed |