Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.46 |
| ▸ | MPO | P05164 | 5/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | FPR2 | P25090 | 2/20 | 0.40 |
| ▸ | FPR3 | P25089 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | BRD2 | P25440 | 1/20 | 0.39 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.39 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19584858 | 0.87 | NPC1 (0.45) | NPC1PDPK1PTGDR2HDAC1HDAC8 | |
| SCHEMBL7448203 | 0.83 | MPO (0.57) | MPOSLC6A4MTNR1ATLR8 | |
| SCHEMBL26938435 | 0.81 | PDPK1 (0.56) | DGAT1MPOSLC6A4NPC1PDPK1 | |
| SCHEMBL12473692 | 0.81 | DGAT1 (0.50) | DGAT1NPC1PDPK1BRD4BRD2 | |
| SCHEMBL14430303 | 0.79 | PDPK1 (0.47) | DGAT1PDPK1PTGDR2 | |
| SCHEMBL29604377 | 0.79 | PDPK1 (0.47) | DGAT1PDPK1PTGDR2 | |
| SCHEMBL1487566 | 0.79 | CA2 (0.42) | DGAT1NPC1PDPK1BRD4BRD2 | |
| SCHEMBL14432149 | 0.78 | DGAT1 (0.41) | DGAT1NPC1FPR2FPR3BRD4 | |
| SCHEMBL19584645 | 0.78 | AAK1 (0.39) | NPC1PDPK1FPR2FPR3BRD4 | |
| SCHEMBL28743936 | 0.78 | PDPK1 (0.43) | DGAT1NPC1PDPK1BRD4BRD2 |
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-2655371-A1 | PYRAZOLOPIPERIDINE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS | Boehringer Ingelheim International GmbH (DE) | 2013-10-30 | — | — | EP | disclosed |
| WO-2012087782-A1 | PYRAZOLOPIPERIDINE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-06-28 | — | — | WO | disclosed |