Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.51 |
| ▸ | NOS1 | P29475 | 1/20 | 0.51 |
| ▸ | NOS2 | P35228 | 1/20 | 0.51 |
| ▸ | MTNR1A | P48039 | 6/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 6/20 | 0.50 |
| ▸ | WDR5 | P61964 | 6/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL25199502 | 0.87 | WDR5 (0.48) | NOS3NOS1NOS2MTNR1AMTNR1B | |
| SCHEMBL7230462 | 0.79 | NOS1 (0.56) | NOS3NOS1NOS2MTNR1AMTNR1B | |
| SCHEMBL17801961 | 0.79 | NPSR1 (0.51) | WDR5KMT2ANPSR1SMN1; SMN2 | |
| SCHEMBL31570649 | 0.78 | NOS2 (0.59) | NOS3NOS1NOS2WDR5 | |
| SCHEMBL15543495 | 0.78 | NPSR1 (0.50) | KMT2ANPSR1CYP1A2SMN1; SMN2 | |
| SCHEMBL15745621 | 0.78 | NPSR1 (0.50) | MTNR1AMTNR1BKMT2ANPSR1SMN1; SMN2 | |
| SCHEMBL30001281 | 0.78 | NPSR1 (0.50) | KMT2ANPSR1CYP1A2SMN1; SMN2 | |
| SCHEMBL23446458 | 0.78 | NPSR1 (0.50) | KMT2AMEN1NPSR1SMN1; SMN2 | |
| SCHEMBL15709975 | 0.78 | NOS3 (0.54) | NOS3NOS1NOS2KMT2AMEN1 | |
| SCHEMBL30451523 | 0.78 | NPSR1 (0.50) | WDR5KMT2AMEN1NPSR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3227263-A1 | CXCR7 RECEPTOR MODULATORS | Actelion Pharmaceuticals Ltd (CH) | 2017-10-11 | — | — | EP | claimed |
| WO-2016087370-A1 | CXCR7 RECEPTOR MODULATORS | ACTELION PHARMACEUTICALS LTD (CH) | 2016-06-09 | — | — | WO | claimed |
| EP-3227263-A1 | CXCR7 RECEPTOR MODULATORS | Actelion Pharmaceuticals Ltd (CH) | 2017-10-11 | — | — | EP | disclosed |
| WO-2016087370-A1 | CXCR7 RECEPTOR MODULATORS | ACTELION PHARMACEUTICALS LTD (CH) | 2016-06-09 | — | — | WO | disclosed |