Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | PORCN | Q9H237 | 2/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.47 |
| ▸ | RAF1 | P04049 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | CRHBP | P24387 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.44 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.43 |
| ▸ | BRAF | P15056 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.42 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.42 |
| ▸ | KIT | P10721 | 1/20 | 0.42 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.42 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | TTK | P33981 | 1/20 | 0.41 |
| ▸ | ITK | Q08881 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9102775 | 0.87 | SMN1; SMN2 (0.49) | HPGDSMN1; SMN2PORCNFAAHNPC1 | |
| SCHEMBL9106342 | 0.84 | ALDH1A1 (0.51) | HPGDSMN1; SMN2PORCNNPC1RAB9A | |
| SCHEMBL4475028 | 0.83 | PGR (0.52) | HPGDSMN1; SMN2RAF1NPC1RAB9A | |
| SCHEMBL9100139 | 0.82 | KDR (0.60) | RAF1BRAFKDRMAPK14TNNI3K | |
| SCHEMBL5729489 | 0.81 | PORCN (0.46) | HPGDSMN1; SMN2PORCNNPC1RAB9A | |
| SCHEMBL5725866 | 0.78 | CDK8 (0.50) | FAAHRAB9ABRAFKDRMAPK14 | |
| SCHEMBL5725295 | 0.77 | ICMT (0.46) | NPC1RAB9AMAPT | |
| SCHEMBL15140688 | 0.77 | PORCN (0.64) | SMN1; SMN2PORCNFAAHALDH1A1MAPT | |
| SCHEMBL10063117 | 0.76 | ITK (0.61) | HPGDNPC1RAB9AKDRPGR | |
| SCHEMBL9101092 | 0.76 | KDR (0.49) | HPGDSMN1; SMN2PORCNRAF1NPC1 |
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-1685125-B1 | Pyrrole derivatives useful for the treatment of proliferative diseases | MERCK PATENT GMBH (DE) | 2012-06-06 | — | — | EP | disclosed |