Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 3/20 | 0.55 |
| ▸ | RAF1 | P04049 | 10/20 | 0.50 |
| ▸ | KDR | P35968 | 7/20 | 0.50 |
| ▸ | BRAF | P15056 | 5/20 | 0.50 |
| ▸ | CDK8 | P49336 | 3/20 | 0.50 |
| ▸ | FLT1 | P17948 | 3/20 | 0.50 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.50 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.50 |
| ▸ | ABL1 | P00519 | 2/20 | 0.50 |
| ▸ | HTR1A | P08908 | 2/20 | 0.50 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.50 |
| ▸ | KIT | P10721 | 2/20 | 0.50 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.50 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.50 |
| ▸ | MAOA | P21397 | 2/20 | 0.50 |
| ▸ | EPHA1 | P21709 | 2/20 | 0.50 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.50 |
| ▸ | EPHA2 | P29317 | 2/20 | 0.50 |
| ▸ | TTK | P33981 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9102135 | 0.92 | RAF1 (0.55) | RETRAF1KDRBRAFCDK8 | |
| SCHEMBL9105151 | 0.91 | RAF1 (0.50) | RETRAF1KDRBRAFCDK8 | |
| SCHEMBL9100193 | 0.91 | CDK8 (0.42) | RETRAF1KDRBRAFCDK8 | |
| SCHEMBL4466558 | 0.88 | RET (0.71) | RETRAF1KDRBRAFCDK8 | |
| SCHEMBL9098846 | 0.88 | KDR (0.49) | RETRAF1KDRBRAFCDK8 | |
| SCHEMBL9102040 | 0.88 | CDK8 (0.45) | RETKDRCDK8FLT1MEN1 | |
| SCHEMBL9099762 | 0.85 | KDR (0.42) | RETRAF1KDRBRAFABL1 | |
| SCHEMBL5724635 | 0.84 | KDR (0.53) | RETRAF1KDRBRAFCDK8 | |
| SCHEMBL1380435 | 0.82 | RAF1 (0.46) | RETRAF1KDRCDK8FLT1 | |
| SCHEMBL4474992 | 0.80 | RAF1 (0.72) | RETRAF1KDRBRAFCDK8 |
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-1685125-B1 | Pyrrole derivatives useful for the treatment of proliferative diseases | MERCK PATENT GMBH (DE) | 2012-06-06 | — | — | EP | claimed |
| EP-1685125-B1 | Pyrrole derivatives useful for the treatment of proliferative diseases | MERCK PATENT GMBH (DE) | 2012-06-06 | — | — | EP | disclosed |