Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR1 | P25024 | 2/20 | 0.62 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 6/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.46 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5657757 | 0.92 | ALDH1A1 (0.58) | CXCR1CXCR2ALDH1A1HSD17B10MAPK1 | |
| SCHEMBL5660105 | 0.89 | CXCR1 (0.58) | CXCR1CXCR2ALDH1A1HSD17B10MAPK1 | |
| SCHEMBL5657961 | 0.87 | SMN1; SMN2 (0.49) | CXCR1CXCR2ALDH1A1HSD17B10MAPK1 | |
| SCHEMBL5658940 | 0.86 | LMNA (0.45) | CXCR1CXCR2ALDH1A1HSD17B10MAPK1 | |
| SCHEMBL5658611 | 0.85 | CXCR1 (0.46) | CXCR1CXCR2ALDH1A1HSD17B10MAPK1 | |
| SCHEMBL5660845 | 0.85 | CXCR1 (0.47) | CXCR1CXCR2ALDH1A1HSD17B10MAPK1 | |
| SCHEMBL5657939 | 0.84 | CXCR2 (0.53) | CXCR1CXCR2ALDH1A1HSD17B10LMNA | |
| SCHEMBL5658497 | 0.83 | LMNA (0.56) | CXCR1CXCR2ALDH1A1HSD17B10MAPK1 | |
| SCHEMBL5657347 | 0.83 | LMNA (0.46) | CXCR1CXCR2ALDH1A1HSD17B10MAPK1 | |
| SCHEMBL5659538 | 0.83 | CXCR2 (0.56) | CXCR1CXCR2ALDH1A1HSD17B10MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7176310-B1 | Pyrimidinecarboxamide derivatives and their use as anti-inflammatory agents | UCB SA (GB) | 2007-02-13 | — | — | US | claimed |
| US-7176310-B1 | Pyrimidinecarboxamide derivatives and their use as anti-inflammatory agents | UCB SA (GB) | 2007-02-13 | — | — | US | disclosed |