Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR2 | P25025 | 5/20 | 0.53 |
| ▸ | CXCR1 | P25024 | 4/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5657929 | 0.94 | CXCR1 (0.51) | CXCR2CXCR1ALDH1A1KDM4ETSHR | |
| SCHEMBL5659995 | 0.91 | CXCR1 (0.52) | CXCR2CXCR1ALDH1A1KDM4ETSHR | |
| SCHEMBL5657961 | 0.91 | SMN1; SMN2 (0.49) | CXCR2CXCR1ALDH1A1KDM4ETSHR | |
| SCHEMBL5660511 | 0.91 | CXCR1 (0.53) | CXCR2CXCR1ALDH1A1KDM4ETSHR | |
| SCHEMBL5657932 | 0.88 | CXCR2 (0.54) | CXCR2CXCR1ALDH1A1KDM4ETSHR | |
| SCHEMBL5659346 | 0.87 | ALDH1A1 (0.54) | CXCR2CXCR1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL5661145 | 0.87 | LMNA (0.45) | CXCR2CXCR1ALDH1A1KDM4ETSHR | |
| SCHEMBL5658611 | 0.87 | CXCR1 (0.46) | CXCR2CXCR1ALDH1A1KDM4ETSHR | |
| SCHEMBL5658497 | 0.87 | LMNA (0.56) | CXCR2CXCR1ALDH1A1KDM4ETSHR | |
| SCHEMBL5661095 | 0.86 | LMNA (0.51) | CXCR2CXCR1ALDH1A1KDM4ETSHR |
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 |