Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ULK1 | O75385 | 5/20 | 0.49 |
| ▸ | KDR | P35968 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CASP1 | P29466 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CASP7 | P55210 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | NEK2 | P51955 | 1/20 | 0.37 |
| ▸ | IGF1R | P08069 | 3/20 | 0.36 |
| ▸ | PLK1 | P53350 | 2/20 | 0.36 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17554670 | 0.86 | ULK1 (0.68) | ULK1 | |
| SCHEMBL670806 | 0.82 | ULK1 (0.45) | ULK1KDRMEN1CYP1A2CYP2C9 | |
| SCHEMBL669259 | 0.80 | ULK1 (0.43) | ULK1KDRMEN1CYP1A2CYP2C9 | |
| SCHEMBL15024023 | 0.80 | ULK1 (0.75) | ULK1MAOAMAOB | |
| SCHEMBL669815 | 0.79 | ULK1 (0.59) | ULK1 | |
| SCHEMBL17554669 | 0.76 | ULK1 (0.38) | ULK1KDRNEK2MAOAMAOB | |
| SCHEMBL17554664 | 0.74 | ULK1 (0.37) | ULK1KDRNEK2CCNA2CDK2 | |
| SCHEMBL17554673 | 0.74 | ULK1 (0.39) | ULK1KDRNEK2PLK1CCNA2 | |
| SCHEMBL669223 | 0.73 | ULK1 (0.40) | ULK1NEK2PLK1CDK2CDK5 | |
| SCHEMBL669197 | 0.72 | IGF1R (0.59) | KDRMEN1CYP1A2CYP2C9CASP1 |
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-2606034-B1 | PYRIMIDINE DERIVATIVE AS FAK INHIBITORS | MERCK PATENT GMBH (DE) | 2016-03-09 | — | — | EP | claimed |
| EP-2606034-B1 | PYRIMIDINE DERIVATIVE AS FAK INHIBITORS | MERCK PATENT GMBH (DE) | 2016-03-09 | — | — | EP | disclosed |